SCHEMBL10032395

SCHEMBL10032395

Cc1ccc2ccc3ccc(-c4cccc(-c5cccc(-c6cccc(-c7ccc8ccc9ccc(C)cc9c8n7)c6)c5)c4)nc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
CYP2A6 P11509 1/20 0.46
IDO1 P14902 1/20 0.39
METAP2 P50579 1/20 0.39
MAOA P21397 1/20 0.39
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 4/20 0.37
LMNA P02545 3/20 0.37
MAPT P10636 3/20 0.37
HSD17B10 Q99714 1/20 0.37
KMO O15229 1/20 0.37
AR P10275 1/20 0.37
MEN1 O00255 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
ENPP3 O14638 1/20 0.36
HSP90AA1 P07900 1/20 0.36
GAA P10253 1/20 0.36
THRB P10828 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
SCHEMBL10032346 1.00 CYP1A2 (0.46) CYP1A2CYP2A6IDO1METAP2MAOA
SCHEMBL10032420 0.98 CYP1A2 (0.47) CYP1A2CYP2A6IDO1METAP2MAOA
SCHEMBL10032350 0.97 CYP1A2 (0.43) CYP1A2CYP2A6IDO1METAP2MAOA
SCHEMBL10032396 0.94 ENPP3 (0.44) CYP1A2CYP2A6MAOAALDH1A1KDM4E
SCHEMBL10032409 0.94 ENPP3 (0.44) CYP1A2CYP2A6MAOAALDH1A1KDM4E
SCHEMBL10032406 0.91 CYP1A2 (0.41) CYP1A2CYP2A6IDO1METAP2MAOA
SCHEMBL10032443 0.90 MEN1 (0.39) CYP1A2CYP2A6ALDH1A1KDM4EMAPT
SCHEMBL10032349 0.90 MEN1 (0.39) CYP1A2CYP2A6ALDH1A1KDM4EMAPT
SCHEMBL10032344 0.86 CYP1A2 (0.42) CYP1A2CYP2A6METAP2MAOAALDH1A1
SCHEMBL10032314 0.86 ENPP3 (0.37) IDO1METAP2KMOARENPP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-8114529-B2 Material for lighting emitting device and light emitting device TORAY INDUSTRIES, INC. (JP) 2012-02-14 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed
US-20070267958-A1 Material for Light Emitting Device and Light Emitting Device TORAY INDUSTRIES, INC. (JP) 2007-11-22 US disclosed