SCHEMBL2494052

SCHEMBL2494052

Nc1cnc(S)nc1N

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2203226 0.79
SCHEMBL10999669 0.75
SCHEMBL12850008 0.75
SCHEMBL8164956 0.75
SCHEMBL6551835 0.75
SCHEMBL21814360 0.73 HTT (0.37)
SCHEMBL33992 0.72
SCHEMBL29382162 0.72
SCHEMBL13909713 0.72 LMNA (0.36)
SCHEMBL9409112 0.70 DHFR (0.44)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 37 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023126980-A1 MERCAPTOPYRIMIDINE COMPOUNDS THAT INHIBIT NONHOMOLOGOUS END JOINING AND METHODS THEREOF INDIAN INSTITUTE OF SCIENCE (IN) 2023-07-06 WO claimed
CN-106565613-B Liquid crystal cells cooperate with the polyimide alignment film and preparation method thereof of azo orientation 上海交通大学 2018-11-20 CN claimed
EP-0566698-A1 AMINO-SUBSTITUTED PYRIMIDINES, DERIVATIVES AND METHODS OF USE THEREFOR THE ROCKEFELLER UNIVERSITY (US) 1993-10-27 EP claimed
WO-1992011853-A1 AMINO-SUBSTITUTED PYRIMIDINES, DERIVATIVES AND METHODS OF USE THEREFOR THE ROCKEFELLER UNIVERSITY (US) 1992-07-23 WO claimed
CN-113994259-B Photosensitive resin composition, transfer film, cured film, laminate, and method for producing touch panel 富士胶片株式会社 2024-05-28 CN disclosed
CN-117916665-A Colored curable resin composition, color filter, display device, and solid-state imaging element 住友化学株式会社 2024-04-19 CN disclosed
WO-2023126980-A1 MERCAPTOPYRIMIDINE COMPOUNDS THAT INHIBIT NONHOMOLOGOUS END JOINING AND METHODS THEREOF INDIAN INSTITUTE OF SCIENCE (IN) 2023-07-06 WO disclosed
CN-112227064-A Aldehyde nucleophilic addition complexing antibacterial fiber, preparation method and application 上海威露美生物科技有限公司 2021-01-15 CN disclosed
CN-109641904-A The sulphur imido acyl group purine ketone compound that 7- for treating and preventing virus infection replaces 豪夫迈·罗氏有限公司 2019-04-16 CN disclosed
CN-106565613-B Liquid crystal cells cooperate with the polyimide alignment film and preparation method thereof of azo orientation 上海交通大学 2018-11-20 CN disclosed
CN-108752280-A Heat shock protein binding compounds, composition and its preparation and application 纪念斯隆-凯特琳癌症中心 2018-11-06 CN disclosed
CN-107580596-A For treating and preventing the new sulphur imido acyl group purinone compound and derivative of virus infection 豪夫迈·罗氏有限公司 2018-01-12 CN disclosed
WO-1992020816-A1 DETERMINATION OF PRODRUGS METABOLIZABLE BY THE LIVER AND THERAPEUTIC USE THEREOF YALE UNIVERSITY (US) 1992-11-26 WO disclosed
EP-0504279-A1 FERMENTATION PROCESS FOR THE PRODUCTION OF PYRIMIDINE DEOXYRIBONUCLEOSIDES. CHEMGEN CORP (US) 1992-09-23 EP disclosed
WO-1992011853-A1 AMINO-SUBSTITUTED PYRIMIDINES, DERIVATIVES AND METHODS OF USE THEREFOR THE ROCKEFELLER UNIVERSITY (US) 1992-07-23 WO disclosed
US-5089490-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-18 US disclosed
WO-1991009130-A1 FERMENTATION PROCESS FOR THE PRODUCTION OF PYRIMIDINE DEOXYRIBONUCLEOSIDES CHEMGEN CORPORATION (US) 1991-06-27 WO disclosed
EP-0419396-A1 Hydrophilic membrane for use in ultrafiltration and method of preparation DOW DANMARK A/S (DK) 1991-03-27 EP disclosed
US-4758556-A Cephem derivatives HOECHST AKTIENGESELLSCHAFT (DE) 1988-07-19 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed