SCHEMBL16900545

SCHEMBL16900545

Cc1cc(N)ccc1C=Cc1ccc(C=Cc2ccc(N)cc2C)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 13/20 0.49
ALDH1A1 P00352 1/20 0.48
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
NQO2 P16083 2/20 0.44
APP P05067 2/20 0.43
PDE10A Q9Y233 1/20 0.43
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
NFE2L2 Q16236 1/20 0.42
CASP1 P29466 1/20 0.41

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
SCHEMBL9294673 0.98 CYP19A1 (0.52) CYP19A1ALDH1A1MAOAMAOBNQO2
SCHEMBL28304117 0.91 ALDH1A1 (0.56) CYP19A1ALDH1A1PDE10AMEN1NPC1
SCHEMBL9033276 0.91 ALDH1A1 (0.56) CYP19A1ALDH1A1PDE10AMEN1NPC1
SCHEMBL27856085 0.90 CYP19A1 (0.55) CYP19A1ALDH1A1MAOAMAOBNPC1
SCHEMBL10709162 0.86 CYP19A1 (0.49) CYP19A1MAOAMAOBNQO2APP
SCHEMBL10709168 0.86 CYP19A1 (0.49) CYP19A1MAOAMAOBNQO2APP
SCHEMBL28496142 0.81 ALDH1A1 (0.50) ALDH1A1PDE10AMEN1NPC1MAPT
SCHEMBL13763238 0.81 ALDH1A1 (0.50) ALDH1A1PDE10AMEN1NPC1MAPT
SCHEMBL12810945 0.81 ALDH1A1 (0.50) ALDH1A1PDE10AMEN1NPC1MAPT
SCHEMBL17400896 0.80 MAOB (0.48) CYP19A1ALDH1A1MAOAMAOBAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1515192-B1 Electrophotographic photoconductor, electrophotographic process, electrophotographic apparatus, and process cartridge RICOH CO LTD (JP) 2015-07-15 EP disclosed