SCHEMBL1706700

SCHEMBL1706700

[CH2]c1cc(C)cc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.61
CYP2A6 P11509 6/20 0.61
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 3/20 0.41
HIF1A Q16665 1/20 0.41
CYP1B1 Q16678 1/20 0.41
HPGD P15428 1/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 2/20 0.37
TRPM4 Q8TD43 1/20 0.37
HTR2A P28223 1/20 0.35
NQO2 P16083 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL598829 0.76 CYP1A2 (1.00) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL6834828 0.76 ALDH1A1 (0.44) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL29352143 0.76 CYP1A2 (1.00) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL7949503 0.76 CYP2A6 (0.67) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL1649856 0.76 CYP1A2 (0.63) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL5249788 0.74 CYP1A2 (0.46) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
Ammonia Solution, Strong SCHEMBL27919233 0.74 CYP1A2 (0.95) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL1973685 0.73 ALDH1A1 (0.52) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL4767088 0.73 CYP2A6 (0.44) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10
SCHEMBL4074691 0.73 CYP2A6 (0.61) CYP1A2CYP2A6TDP1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10640641-B2 Curable coating compositions of silane functional polymers KING INDUSTRIES (US) 2020-05-05 US disclosed
US-20200062953-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES 2020-02-27 US disclosed
US-20180237635-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES 2018-08-23 US disclosed
US-9976028-B2 Curable coating compositions of silane functional polymers KING INDUSTRIES (US) 2018-05-22 US disclosed
WO-2016137881-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES (US) 2016-09-01 WO disclosed
US-20160244606-A1 CURABLE COATING COMPOSITIONS OF SILANE FUNCTIONAL POLYMERS KING INDUSTRIES 2016-08-25 US disclosed
US-9126987-B2 Inhibitors of glutaminyl cyclase PROBIODRUG AG (DE) 2015-09-08 US disclosed
US-8912113-B2 Compositions of a metal amidine complex and second compound, coating compositions comprising same KING INDUSTRIES, INC. (US) 2014-12-16 US disclosed
EP-2683767-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. (US) 2014-01-15 EP disclosed
WO-2012122098-A1 COMPOSITIONS OF A METAL AMIDINE COMPLEX AND SECOND COMPOUND, COATING COMPOSITIONS COMPRISING SAME KING INDUSTRIES, INC. (US) 2012-09-13 WO disclosed
EP-1070711-A2 Heteroaryl-substituted pyrrole derivatives, their preparation and their therapeutic uses Sankyo Company Limited (JP) 2001-01-24 EP disclosed
EP-1067130-A1 TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2001-01-10 EP disclosed
WO-2000043459-A1 CORROSION-INHIBITING COATING COMPOSITIONS FOR METALS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-07-27 WO disclosed
EP-0835289-B1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS CIBA GEIGY AG (CH) 1999-05-19 EP disclosed
US-5879436-A REACTION PRODUCT OF CARBOXYLIC ACID AND AMINOSILANE; PROTECTIVE COATINGS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-03-09 US disclosed
EP-0835289-A1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS Ciba SC Holding AG (CH) 1998-04-15 EP disclosed
US-5612093-A Titanium and zirconium complexes of carboxylic acids as corrosion inhibitors CIBA-GEIGY CORPORATION (US) 1997-03-18 US disclosed
WO-1997001606-A1 AMINOSILANE SALTS AND SILANAMIDES OF CARBOXYLIC ACIDS AS CORROSION INHIBITORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-01-16 WO disclosed
EP-0244836-B1 TRIPEPTIDE DERIVATIVES Dainippon Pharmaceutical Co., Ltd. (JP) 1993-08-18 EP disclosed
US-4826814-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1989-05-02 US disclosed