SCHEMBL7750867

SCHEMBL7750867

Cc1ccccc1N(c1ccc(C=O)cc1)c1ccc(C=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
ALDH1A3 P47895 2/20 0.50
ALDH3A1 P30838 2/20 0.50
CYP2A6 P11509 4/20 0.48
CYP2A13 Q16696 1/20 0.48
CYP3A4 P08684 2/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
TYR P14679 1/20 0.35
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.34
ALDH5A1 P51649 1/20 0.34
ABAT P80404 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
SCHEMBL7750958 0.96 ALDH1A1 (0.47) ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13
SCHEMBL5182285 0.96 ALDH1A1 (0.50) ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13
SCHEMBL7891040 0.85 ALDH1A1 (0.43) ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13
SCHEMBL17508294 0.84 CYP2A6 (0.52) ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13
SCHEMBL3364536 0.83 APP (0.51) ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13
SCHEMBL4893894 0.82 ACHE (0.43) ALDH1A1CYP2A6CYP3A4LMNATSHR
SCHEMBL18417178 0.81 RELA (0.55) ALDH1A1KDM4E
SCHEMBL5953358 0.81 RELA (0.48) ALDH1A1CYP3A4LMNAKDM4E
SCHEMBL5943062 0.81 RELA (0.48) ALDH1A1CYP3A4LMNAKDM4E
SCHEMBL14445155 0.80 CYP2A6 (0.44) ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0812820-B1 TRIPHENYLAMINE DERIVATIVES, AND CHARGE TRANSPORT MATERIAL AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR PREPARED THEREFROM TAKASAGO PERFUMERY CO LTD (JP) 2001-01-17 EP disclosed
US-6172264-B1 REACTING A TRIPHENYLAMINE WITH A VILSMEIER IN PRESENCE OF ACID CATALYST TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-01-09 US disclosed
US-5989765-A CHARGE TRANSPORT MATERIAL IS A TRIPHENYLAMINE DERIVATIVE WHERE ONE OF THE PHENYL GROUPS OF THE TRIPHENYL AMINE HAS A DIPHENYLBUTADIENYL-SUBSTITUENT AND THE OTHER TWO PHENYL GROUPS HAVE A DIPHENYLBUTADIENYL- OR DIPHENYLVINYL-FRAMEWORK TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-11-23 US disclosed
US-5910610-A Triphenylamine derivative, charge-transporting material comprising the same, and electrophotographic photoreceptor TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-06-08 US disclosed
EP-0812820-A1 TRIPHENYLAMINE DERIVATIVES, AND CHARGE TRANSPORT MATERIAL AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR PREPARED THEREFROM Takasago International Corporation (JP) 1997-12-17 EP disclosed