SCHEMBL15096039

SCHEMBL15096039

C=CCOc1ccc(C(c2ccc(OC)cc2)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
TP53 P04637 2/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
ALOX12 P18054 1/20 0.42
GAA P10253 4/20 0.42
MAPT P10636 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
MAOB P27338 3/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
POLB P06746 1/20 0.39
FLT3 P36888 1/20 0.39
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL827328 0.92 CA12 (0.46) ALDH1A1SMN1; SMN2TP53GAAMAPT
SCHEMBL17860084 0.84 ESR1 (0.56) ALDH1A1SMN1; SMN2TP53GAAMAPT
1-Allyloxy-4-Methoxybenzene SCHEMBL2843640 0.83 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15
SCHEMBL2616610 0.81 CA1 (0.52) ALDH1A1CYP3A4GAAMAPTCA12
SCHEMBL10112762 0.81 CA1 (0.52) ALDH1A1CYP3A4GAAMAPTCA12
SCHEMBL11987211 0.81 CA12 (0.38) ALDH1A1SMN1; SMN2TP53MAPTCA12
SCHEMBL10069439 0.78 MAOB (0.45) ALDH1A1SMN1; SMN2GAAMAOBHSD11B1
SCHEMBL19880405 0.78 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2TP53CYP3A4ALOX15
SCHEMBL1400474 0.78 CA12 (0.49) ALDH1A1SMN1; SMN2TP53MAPTCA12
SCHEMBL17787403 0.76 CYP3A4 (0.51) ALDH1A1SMN1; SMN2CYP3A4TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505962-B2 Adhesive composition containing resin having carbon-carbon multiple bond NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-11-29 US disclosed
US-9505962-B2 Adhesive composition containing resin having carbon-carbon multiple bond NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-11-29 US disclosed
US-20160311979-A1 COMPOSITION FOR FORMING PASSIVATION FILM, INCLUDING RESIN HAVING CARBON-CARBON MULTIPLE BOND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-10-27 US disclosed
US-20160311979-A1 COMPOSITION FOR FORMING PASSIVATION FILM, INCLUDING RESIN HAVING CARBON-CARBON MULTIPLE BOND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-10-27 US disclosed
US-20140374887-A1 COMPOSITION FOR FORMING PASSIVATION FILM, INCLUDING RESIN HAVING CARBON-CARBON MULTIPLE BOND NISSAN CHEMICAL IMDUSTRIES, LTD. (JP) 2014-12-25 US disclosed
US-20140374887-A1 COMPOSITION FOR FORMING PASSIVATION FILM, INCLUDING RESIN HAVING CARBON-CARBON MULTIPLE BOND NISSAN CHEMICAL IMDUSTRIES, LTD. (JP) 2014-12-25 US disclosed
US-20130177763-A1 ADHESIVE COMPOSITION CONTAINING RESIN HAVING CARBON-CARBON MULTIPLE BOND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-11 US disclosed
US-20130177763-A1 ADHESIVE COMPOSITION CONTAINING RESIN HAVING CARBON-CARBON MULTIPLE BOND NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-07-11 US disclosed