SCHEMBL3199545

SCHEMBL3199545

Cc1cc(C)c(CCc2cc(C)c(C)cc2C)cc1C

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.50
ALDH1A1 P00352 3/20 0.42
PGK1 P00558 1/20 0.39
PGK2 P07205 1/20 0.39
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
CYP1A2 P05177 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP7 P55210 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 2/20 0.36
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
LMNA P02545 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL29737291 1.00 NPSR1 (0.50) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL597339 0.85 NPSR1 (0.44) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL30369685 0.85 NPSR1 (0.44) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL1251783 0.83 TAAR1 (0.58) NPSR1ALDH1A1CYP3A4TSHRMAPK1
SCHEMBL28636923 0.83 NPSR1 (0.48) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL5597967 0.83 NPSR1 (0.43) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL12471361 0.83 NPSR1 (0.43) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL27698295 0.83 NPSR1 (0.43) NPSR1ALDH1A1PGK1PGK2CYP3A4
SCHEMBL22381403 0.81 TAAR1 (0.55) ALDH1A1TAAR1ALOX15HSD17B10MAPT
SCHEMBL7923375 0.81 MAOA (0.42) NPSR1ALDH1A1TAAR1ALOX15HSD17B10

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2121880-A None JP disclosed
EP-2135671-B1 Catalyst and method for producing carboxylic acid and/or carboxylic anhydride in the presence of the catalyst MITSUBISHI GAS CHEMICAL CO (JP) 2015-03-04 EP disclosed
US-8357625-B2 Catalyst and method for producing carboxylic acid and/or carboxylic anhydride in the presence of the catalyst MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2013-01-22 US disclosed
US-20100036138-A1 CATALYST AND METHOD FOR PRODUCING CARBOXYLIC ACID AND/OR CARBOXYLIC ANHYDRIDE IN THE PRESENCE OF THE CATALYST MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2010-02-11 US disclosed
EP-2135671-A2 Catalyst and method for producing carboxylic acid and/or carboxylic anhydride in the presence of the catalyst Mitsubishi Gas Chemical Company, Inc. (JP) 2009-12-23 EP disclosed
EP-1199185-A1 THERMAL RECORDING MATERIAL Nippon Steel Chemical Co., Ltd. (JP) 2002-04-24 EP disclosed
EP-0367228-B1 Heat-sensitive recording material ASAHI DENKA KOGYO KK (JP) 1994-07-20 EP disclosed
EP-0464502-B1 Heat-sensitive recording material ASAHI DENKA KOGYO KK (JP) 1994-02-16 EP disclosed
US-5175138-A Containing organic phosphate ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1992-12-29 US disclosed
EP-0464502-A1 Heat-sensitive recording material ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1992-01-08 EP disclosed
US-4980336-A 1,2-bis(3,4-dimethylphenyl)ethane sensitizer ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1990-12-25 US disclosed
EP-0367228-A2 Heat-sensitive recording material ASAHI DENKA KOGYO KABUSHIKI KAISHA (JP) 1990-05-09 EP disclosed
JP-H02121880-A THERMAL RECORDING MATERIAL ADEKA ARGUS CHEM CO LTD 1990-05-09 JP disclosed