SCHEMBL10128969

SCHEMBL10128969

Nc1ccc(/C=C/C2=CC=CCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 14/20 0.47
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
APP P05067 3/20 0.42
NQO2 P16083 2/20 0.36
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
MAPT P10636 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
KDM1A O60341 1/20 0.30

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
SCHEMBL14401242 0.82 NFE2L2 (0.44) APPNQO2
SCHEMBL22268556 0.81 MAOB (0.38) CYP19A1MAOAMAOBMEN1KMT2A
SCHEMBL5499439 0.81 MAOB (0.38) CYP19A1MAOAMAOBMEN1KMT2A
SCHEMBL22333986 0.79 MAPT (0.38) MEN1NPC1MAPTRAB9AKMT2A
SCHEMBL14215914 0.78 APP (0.47) APP
SCHEMBL13264685 0.78 RELA (0.49) APPNQO2MEN1NPC1MAPT
SCHEMBL13264673 0.74
SCHEMBL12031123 0.71 P4HB (0.43)
SCHEMBL29263238 0.71 MAOB (0.50) CYP19A1MAOAMAOBNPC1MAPT
SCHEMBL14215915 0.71 CYP19A1 (0.44) CYP19A1MAOAMAOBAPPNQO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207526-B2 Organic EL device IDEMITSU KOSAN CO., LTD. (JP) 2012-06-26 US disclosed
US-20100044689-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-02-25 US disclosed