SCHEMBL27596901

SCHEMBL27596901

COC(=O)N1C=CSC1

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
Hydrochloric Acid SCHEMBL27643707 0.98 TSHR (0.32)
Hydrochloric Acid SCHEMBL27665005 0.79 TSHR (0.34)
SCHEMBL27571933 0.79 USP2 (0.37)
Hydrochloric Acid SCHEMBL27599189 0.79 TSHR (0.34)
SCHEMBL28007476 0.71
SCHEMBL28218588 0.71
SCHEMBL28332133 0.65
SCHEMBL4196209 0.64
SCHEMBL3588715 0.62 MAPK1 (0.35)
SCHEMBL27348052 0.62 TSHR (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111601810-A Inhibitors of indoleamine 2, 3-dioxygenase and/or tryptophan 2, 3-dioxygenase 爱杜西亚药品有限公司 2020-08-28 CN disclosed
CN-110997682-A Inhibitors of indoleamine 2, 3-dioxygenase and/or tryptophan 2, 3-dioxygenase 爱杜西亚药品有限公司 2020-04-10 CN disclosed
CN-108024992-A Aryl, Heteroaryl and Heterocyclic Compounds for the Treatment of Medical Disorders 艾其林医药公司 2018-05-11 CN disclosed
CN-104350059-B There is the thiazolopyridin ketone of weeding and insecticidal activity 拜耳知识产权有限责任公司 2016-12-07 CN disclosed
CN-105612162-A Thiazolopyrimidinones as modulators of NMDA receptor activity HOFFMANN LA ROCHE 2016-05-25 CN disclosed
CN-105439977-A Preparation methods for acotiamide and hydrochloride thereof GUANGZHOU REGENEX CORP 2016-03-30 CN disclosed
CN-103189376-B There is ketone group sultam and the diketo pyridine of weeding activity BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-02-24 CN disclosed
CN-103068814-B Anthranilic acid derivative BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-11-25 CN disclosed
CN-105051029-A Thiazolecarboxamide and picolinamide compounds useful as PIM kinase inhibitors INCYTE CORP 2015-11-11 CN disclosed
CN-104892544-A Improved acotiamide intermediate preparation method BEIJING HOPE INTERNAT PHARMACEUTICAL TECHNOLOGY DEV CO LTD 2015-09-09 CN disclosed
CN-101959882-A Imidazole carbonyl compound DAIICHI SANKYO CO LTD 2011-01-26 CN disclosed
CN-101558066-A Pyrrole derivatives with antibacterial activity ASTRAZENECA AB (SE) 2009-10-14 CN disclosed
CN-101541801-A Fused heterocyclic derivative and use thereof TAKEDA PHARMACEUTICAL (JP) 2009-09-23 CN disclosed
CN-101389627-A Pyrrolopyridines, pyrrolopyrimidines and pyrroloazepines  with antibacterial action ASTRAZENECA AB (SE) 2009-03-18 CN disclosed
CN-101277946-A Heterocyclylamide-substituted thiazoles, pyrroles and thiophenes BAYER HEALTHCARE AG (DE) 2008-10-01 CN disclosed
CN-101048418-A PI 3-kinase BOEHRINGER INGELHEIM INT (DE) 2007-10-03 CN disclosed
CN-1886376-A Pyridine compounds as dipeptidyl dipeptidase-IV inhibitors TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-12-27 CN disclosed
CN-1832934-A Benzoxazepine-based compound TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2006-09-13 CN disclosed
CN-1636563-A Thiazole derivatives AVON PROD INC (US) 2005-07-13 CN disclosed
CN-1478084-A Compounds useful in treatment of inflammatory diseases 2004-02-25 CN disclosed