SCHEMBL387041

SCHEMBL387041

CCSc1cc[c]cc1

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
SCHEMBL2879670 0.80 CA12 (0.47)
SCHEMBL346860 0.80 SLC6A4 (0.56)
SCHEMBL4469660 0.77 MAOA (0.49)
SCHEMBL10505592 0.75 ALDH1A1 (0.34)
SCHEMBL5376886 0.75 MAOA (0.43)
SCHEMBL11281750 0.74
SCHEMBL7667277 0.74
SCHEMBL11282965 0.74
SCHEMBL5540414 0.74 SLC6A4 (0.47)
SCHEMBL1031599 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114213353-A Aryl-oxazole-oxazoline compound and preparation method and application thereof 贵州大学 2022-03-22 CN claimed
EP-3143060-B1 CATALYSTS FOR THE SYNTHESIS OF OXAZOLIDINONE COMPOUNDS COVESTRO DEUTSCHLAND AG (DE) 2020-06-24 EP claimed
CN-107141391-B Ethylene-polar styrene quasi-random copolymer and preparation method thereof 中国科学院长春应用化学研究所 2020-03-13 CN claimed
US-20170081462-A1 CATALYSTS FOR THE SYNTHESIS OF OXAZOLIDINONE COMPOUNDS COVESTRO DEUTSCHLAND AG (DE) 2017-03-23 US claimed
EP-3143060-A1 CATALYSTS FOR THE SYNTHESIS OF OXAZOLIDINONE COMPOUNDS Covestro Deutschland AG (DE) 2017-03-22 EP claimed
WO-2015173111-A1 CATALYSTS FOR THE SYNTHESIS OF OXAZOLIDINONE COMPOUNDS COVESTRO DEUTSCHLAND AG (DE) 2015-11-19 WO claimed
EP-1373191-B1 ACYLATED INDANYL AMINES AND THEIR USE AS PHARMACEUTICALS SANOFI AVENTIS DEUTSCHLAND (DE) 2013-06-05 EP claimed
US-8163751-B2 Acylated indanyl amines and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-04-24 US claimed
US-7915258-B2 Substituted 2,5-dihydro-3H-pyrazolo[4,3-C]pyridazin-3-one derivatives, preparation thereof and therapeutic use of the same SANOFI-AVENTIS (FR) 2011-03-29 US claimed
EP-2094706-B1 SUBSTITUTED 2,5-DFFLYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS SANOFI AVENTIS (FR) 2011-01-05 EP claimed
WO-1997005878-A1 2,5-SUBSTITUTED ARYL PYRROLES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK & CO., INC. (US) 1997-02-20 WO claimed
EP-0507317-B1 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMA CO LTD (JP) 1997-01-15 EP claimed
EP-0507317-A2 Biguanide derivatives, manufacturing method thereof, and disinfectants containing the derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP claimed
US-4960768-A Acyloxythiophene-carboxamide fungicides BAYER AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
US-4863954-A Acyloxythiophene-carboxamide fungicides BAYER AKTIENGESELLSCHAFT (DE) 1989-09-05 US claimed
EP-0241735-A2 Acyloxythiophene carbon amide BAYER AG (DE) 1987-10-21 EP claimed
EP-0082404-B1 NOVEL FORMS OF DIFLUNISAL AND RELATED COMPOUNDS MERCK & CO. INC. (US) 1986-02-12 EP claimed
EP-0141909-A2 E-Triazolylpentenols, process for their preparation and biocides and plant growth regulators containing them SCHERING AKTIENGESELLSCHAFT (DE) 1985-05-22 EP claimed
EP-0134515-A1 Azolyl-propane nitriles, method for the preparation of these compounds and biocide agents containing them SCHERING AKTIENGESELLSCHAFT (DE) 1985-03-20 EP claimed
US-4303652-A Fiber-reactive phosphorus mothproofing agents COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1981-12-01 US claimed