SCHEMBL6445924

SCHEMBL6445924

CC(C)(c1ccccc1)c1cc(-n2nc3ccccc3n2)cc(C(C)(C)c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.52
HPGD P15428 3/20 0.52
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
HTT P42858 1/20 0.42
ALDH1A1 P00352 6/20 0.41
NPC1 O15118 6/20 0.41
RAB9A P51151 6/20 0.41
MEN1 O00255 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
STAT1 P42224 1/20 0.41
ESR1 P03372 2/20 0.40
ESR2 Q92731 2/20 0.40
CYP3A4 P08684 1/20 0.40
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
SMN1; SMN2 Q16637 4/20 0.36
TP53 P04637 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL22271031 0.89 KDM4E (0.41) KDM4EHPGDPPARGPPARAHTT
SCHEMBL29351747 0.87 PPARG (0.41) KDM4EHPGDPPARGPPARAHTT
SCHEMBL3680277 0.87 PPARG (0.41) KDM4EHPGDPPARGPPARAHTT
SCHEMBL5561249 0.86 PPARG (0.41) KDM4EHPGDPPARGPPARAHTT
SCHEMBL8680274 0.84 CNR1 (0.40) KDM4EHPGDPPARGPPARAHTT
SCHEMBL20404620 0.84 KDM4E (0.52) KDM4EHPGDPPARGPPARAHTT
SCHEMBL4159028 0.81 PPARG (0.46) KDM4EHPGDPPARGPPARAHTT
SCHEMBL20404520 0.78 KDM4E (0.46) KDM4EHPGDPPARGPPARAHTT
SCHEMBL30648256 0.77 KDM4E (0.53) KDM4EHPGDPPARGPPARAHTT
SCHEMBL29145880 0.77 KDM4E (0.53) KDM4EHPGDPPARGPPARAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2974526-B1 STACK INCLUDING HEATER LAYER AND DRAIN LAYER PPG IND OHIO INC (US) 2020-05-27 EP disclosed
US-10662377-B2 Liquid-crystalline medium MERCK PATENT GMBH (DE) 2020-05-26 US disclosed
US-20190106626-A1 LIQUID-CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 2019-04-11 US disclosed
EP-2667947-B1 UV-PHOTO-PROTECTING COSMETIC COMPOSITION MOMENTIVE PERFORMANCE MAT GMBH (DE) 2018-07-25 EP disclosed
EP-1595920-B1 Polymer alloy, thermoplastic resin composition, and molded article TORAY INDUSTRIES (JP) 2015-01-07 EP disclosed
EP-1595920-A1 Polymer alloy, thermoplastic resin composition, and molded article TORAY INDUSTRIES, INC. (JP) 2005-11-16 EP disclosed