SCHEMBL652643

SCHEMBL652643

Nc1ccc(-c2ccc(N)c(C=Cc3ccccc3)c2C=Cc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 6/20 0.55
MAOA P21397 2/20 0.55
MAOB P27338 2/20 0.55
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1B1 Q16678 1/20 0.39
NFE2L2 Q16236 1/20 0.38
APP P05067 2/20 0.36
ALDH1A1 P00352 3/20 0.34
GRM4 Q14833 1/20 0.34
KDM4E B2RXH2 2/20 0.33
RAB9A P51151 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL28285296 0.79 NFE2L2 (0.46) CYP19A1MAOAMAOBNFE2L2ALDH1A1
SCHEMBL14160333 0.76 CYP19A1 (0.86) CYP19A1MAOAMAOBHSD17B10CYP3A4
SCHEMBL5337738 0.75 CYP19A1 (0.57) CYP19A1MAOAMAOBHSD17B10CYP3A4
SCHEMBL5337729 0.75 CYP19A1 (0.57) CYP19A1MAOAMAOBHSD17B10CYP3A4
SCHEMBL2786941 0.74 CYP19A1 (0.61) CYP19A1MAOAMAOBHSD17B10CYP3A4
SCHEMBL27538754 0.73 CYP19A1 (0.55) CYP19A1MAOAMAOBHSD17B10CYP3A4
(E)-4-Styrylaniline SCHEMBL219628 0.73 CYP19A1 (1.00) CYP19A1MAOAMAOBHSD17B10CYP3A4
(E)-4-Styrylaniline SCHEMBL6757469 0.73 CYP19A1 (1.00) CYP19A1MAOAMAOBHSD17B10CYP3A4
(E)-4-Styrylaniline SCHEMBL219627 0.73 CYP19A1 (1.00) CYP19A1MAOAMAOBHSD17B10CYP3A4
SCHEMBL5346830 0.73 CYP19A1 (0.46) CYP19A1MAOAMAOBHSD17B10CYP3A4

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-8120019-B2 Organic light-emitting element having tetracyano compound and display device CANON KABUSHIKI KAISHA (JP) 2012-02-21 US disclosed
US-20090166615-A1 ORGANIC LIGHT-EMITTING ELEMENT AND DISPLAY DEVICE CANON KABUSHIKI KAISHA (JP) 2009-07-02 US disclosed