Kaminskyy Danylo, Kryshchyshyn Anna, Lesyk Roman
Department of Pharmaceutical, Organic and Bioorganic Chemistry, Danylo Halytsky Lviv National Medical University, Pekarska 69, Lviv-10, 79010, Ukraine.
Department of Pharmaceutical, Organic and Bioorganic Chemistry, Danylo Halytsky Lviv National Medical University, Pekarska 69, Lviv-10, 79010, Ukraine.
Eur J Med Chem. 2017 Nov 10;140:542-594. doi: 10.1016/j.ejmech.2017.09.031. Epub 2017 Sep 20.
The presented review is an attempt to summarize a huge volume of data on 5-ene-4-thiazolidinones being a widely studied class of small molecules used in modern organic and medicinal chemistry. The manuscript covers approaches to the synthesis of 5-ene-4-thiazolidinone derivatives: modification of the C5 position of the basic core; synthesis of the target compounds in the one-pot or multistage reactions or transformation of other related heterocycles. The most prominent pharmacological profiles of 5-ene derivatives of different 4-thiazolidinone subtypes belonging to hit-, lead-compounds, drug-candidates and drugs as well as the most studied targets have been discussed. Currently target compounds (especially 5-en-rhodanines) are assigned as frequent hitters or pan-assay interference compounds (PAINS) within high-throughput screening campaigns. Nevertheless, the crucial impact of the presence/nature of C5 substituent (namely 5-ene) on the pharmacological effects of 5-ene-4-thiazolidinones was confirmed by the numerous listed findings from the original articles. The main directions for active 5-ene-4-thiazolidinones optimization have been shown: i) complication of the fragment in the C5 position; ii) introduction of the substituents in the N3 position (especially fragments with carboxylic group or its derivatives); iii) annealing in complex heterocyclic systems; iv) combination with other pharmacologically attractive fragments within hybrid pharmacophore approach. Moreover, the utilization of 5-ene-4-thiazolidinones in the synthesis of complex compounds with potent pharmacological application is described. The chemical transformations cover mainly the reactions which involve the exocyclic double bond in C5 position of the main core and correspond to the abovementioned direction of the 5-ene-4-thiazolidinone modification.
本综述旨在总结大量关于5-烯-4-噻唑烷酮的数据,5-烯-4-噻唑烷酮是现代有机化学和药物化学中广泛研究的一类小分子。该手稿涵盖了5-烯-4-噻唑烷酮衍生物的合成方法:基本核心C5位的修饰;在一锅法或多步反应中合成目标化合物,或其他相关杂环的转化。讨论了不同4-噻唑烷酮亚型的5-烯衍生物作为先导化合物、候选药物和药物的最显著药理特性,以及研究最多的靶点。目前,在高通量筛选活动中,目标化合物(尤其是5-烯-若丹宁)被认定为频繁命中化合物或泛测定干扰化合物(PAINS)。然而,原始文章中列出的大量研究结果证实了C5取代基(即5-烯)的存在/性质对5-烯-4-噻唑烷酮药理作用的关键影响。已展示了活性5-烯-4-噻唑烷酮优化的主要方向:i)C5位片段的复杂化;ii)在N3位引入取代基(尤其是含羧基或其衍生物的片段);iii)在复杂杂环系统中退火;iv)在杂合药效团方法中与其他具有药理吸引力的片段结合。此外,还描述了5-烯-4-噻唑烷酮在具有强大药理应用的复杂化合物合成中的应用。化学转化主要涵盖涉及主核C5位环外双键的反应,与上述5-烯-4-噻唑烷酮修饰方向一致。