SCHEMBL826807

SCHEMBL826807

N#Cc1ccoc1

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
SCHEMBL28109728 0.97
SCHEMBL4442511 0.90 ALDH1A1 (0.35)
SCHEMBL2968774 0.90 ALDH1A1 (0.35)
Ammonia Solution, Strong SCHEMBL3939813 0.88 ALDH1A1 (0.34)
Biphenyl SCHEMBL27717131 0.86 TSHR (0.48)
SCHEMBL7404111 0.76 MMP3 (0.50)
SCHEMBL28312706 0.76 ADORA2A (0.39)
SCHEMBL7407696 0.76 MMP3 (0.50)
SCHEMBL133203 0.71
SCHEMBL3094064 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3790876-B1 ENDOPARASITIC DEPSIPEPTIDES ZOETIS SERVICES LLC (US) 2025-04-30 EP claimed
CN-112384511-B Endoparasite depsipeptides 硕腾服务有限责任公司 2024-01-30 CN claimed
CN-113135878-A Method for synthesizing 3-aminomethyl tetrahydrofuran by taking furan as raw material 新沂市凯美斯特医药科技有限公司 2021-07-20 CN claimed
CN-104945540-A Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORP 2015-09-30 CN claimed
CN-104829627-A Chiral hexahydrofuro [2,3-b] furan-3-methylamine, and preparation method and application thereof UNIV SOUTHEAST 2015-08-12 CN claimed
EP-1896492-B1 PLATINUM COMPLEXES WITH MONONITRILE-CONTAINING LIGANDS BIONUMERIK PHARMACEUTICALS INC (US) 2014-03-19 EP claimed
EP-2114394-B1 PLATINUM ANALOGS WITH BIS-NITRILE-CONTAINING LIGANDS BIONUMERIK PHARMACEUTICALS INC (US) 2012-08-15 EP claimed
CN-101874044-A Polymers functionalized with heterocyclic nitrile compounds BRIDGESTONE CORP 2010-10-27 CN claimed
US-7777060-B2 Platinum analogs with bis-nitrile-containing ligands BIONUMERIK PHARMACEUTICALS, INC. (US) 2010-08-17 US claimed
EP-2203482-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS Bridgestone Corporation (JP) 2010-07-07 EP claimed
EP-2114394-A1 PLATINUM ANALOGS WITH BIS-NITRILE-CONTAINING LIGANDS BIONUMERIK PHARMACEUTICALS, INC. (US) 2009-11-11 EP claimed
WO-2009051702-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (JP) 2009-04-23 WO claimed
WO-2009051700-A1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC NITRILE COMPOUNDS BRIDGESTONE CORPORATION (US) 2009-04-23 WO claimed
WO-2008100301-A1 PLATINUM ANALOGS WITH BIS-NITRILE-CONTAINING LIGANDS BIONUMERIK PHARMACEUTICALS, INC. (US) 2008-08-21 WO claimed
US-20080194680-A1 Platinum analogs with bis-nitrile-containing ligands BIONUMERIK PHARMACEUTICALS, INC. 2008-08-14 US claimed
EP-1327630-B1 NEW DERIVATIVES OF CYANO-ARYL (OR CYANOHETEROARYL)-CARBONYL-PIPERAZINYL-PYRIMIDINES, THEIR PREPARATION AND APPLICATION AS MEDICATION ESTEVE LABOR DR (ES) 2007-12-12 EP claimed
US-7300937-B2 Derivatives of cyano-aryl (or cyanoheteroaryl)-carbonyl-piperazinyl-pyrimidines, their preparation and application as medication LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-11-27 US claimed
CN-1606551-A Substituted 2-phenyl benzofurans as estrogenic agents WYETH CORP (US) 2005-04-13 CN claimed
US-20040048872-A1 New derivatives of cyano-aryl (or cyanoheteroaryl) -carbonyl- piperazinyl - pyrimidines, their preparation and application as medication LABORATORIES DEL DR. ESTEVE, S.A. (ES) 2004-03-11 US claimed
EP-1327630-A1 NEW DERIVATIVES OF CYANO-ARYL (OR CYANOHETEROARYL)-CARBONYL-PIPERAZINYL-PYRIMIDINES, THEIR PREPARATION AND APPLICATION AS MEDICATION LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2003-07-16 EP claimed