SCHEMBL1258403

SCHEMBL1258403

CCON(CC)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GLA P06280 1/20 0.42
TP53 P04637 2/20 0.37
KCNH2 Q12809 2/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADRA1A P35348 1/20 0.36
OPRM1 P35372 1/20 0.36
DRD3 P35462 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
LTA4H P09960 1/20 0.34

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
SCHEMBL2211961 0.86 ALDH1A1 (0.38) TSHRALDH1A1GLATP53KCNH2
SCHEMBL9289411 0.83 TP53 (0.43) TSHRALDH1A1GLATP53KCNH2
SCHEMBL27491750 0.81 TSHR (0.52) TSHRALDH1A1GLATP53SMN1; SMN2
SCHEMBL14191789 0.80 TSHR (0.41) TSHRALDH1A1MEN1KMT2ACNR2
SCHEMBL11642255 0.79 NPC1 (0.41) ALDH1A1TP53KCNH2CHRM2HTR1A
SCHEMBL2911078 0.79 LTA4H (0.44) TSHRALDH1A1GLAKCNH2CHRM2
SCHEMBL1257089 0.79 TSHR (0.43) TSHRALDH1A1GLATP53KCNH2
SCHEMBL6816251 0.78 TDP1 (0.54) TSHRALDH1A1TP53MEN1KMT2A
SCHEMBL27925961 0.78 GLA (0.48) TSHRALDH1A1GLATP53SMN1; SMN2
SCHEMBL19489580 0.78 HPGD (0.42) TSHRALDH1A1TP53MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107108818-A Particle for electrophoretic display device (EPD) 默克专利股份有限公司 2017-08-29 CN disclosed
CN-104607074-A Method for preparing reverse osmosis composite membrane containing azobenzene polyamide UNIV GUANGDONG TECHNOLOGY 2015-05-13 CN disclosed
US-20110039324-A1 COMPOSITIONS AND METHODS FOR ENHANCING APOPTOSIS GENENTECH, INC. (US) 2011-02-17 US disclosed
EP-2220100-A2 CHIRAL CYCLOPLATINIZED COMPLEXES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN MEDICINE AND CATALYSTS Rheinisch-Westfälisch-Technische Hochschule Aachen (DE) 2010-08-25 EP disclosed
WO-2009077462-A2 CHIRAL CYCLOPLATINIZED COMPLEXES, METHOD FOR THE PRODUCTION THEREOF AND THEIR USE IN MEDICINE AND CATALYSTS Rheinisch-Westfälische Technische Hochschule Aachen (DE) 2009-06-25 WO disclosed
US-4076849-A AROMATIC SECONDARY AMINES CANADA PACKERS LIMITED (CA) 1978-02-28 US disclosed
US-3991043-A Quaternization of benzthiazole-azo compounds TOMS RIVER CHEMICAL CORPORATION (US) 1976-11-09 US disclosed