SCHEMBL13929902

SCHEMBL13929902

COc1cccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(C)cc5)c5cccc(OC)c5)cc4)cc3)cc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.48
ADRA2A P08913 2/20 0.47
ADRA1A P35348 2/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
ADRA1D P25100 1/20 0.47
ADRA1B P35368 1/20 0.47
HSD17B2 P37059 4/20 0.46
HSD17B1 P14061 3/20 0.46
ALKBH3 Q96Q83 1/20 0.46
MAOB P27338 2/20 0.45
MTNR1A P48039 4/20 0.42
MTNR1B P49286 4/20 0.42
ALOX15 P16050 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL18052478 1.00 ACHE (0.48) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL9581416 1.00 ACHE (0.48) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL9581431 0.95 ALKBH3 (0.46) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL3442401 0.95 ALKBH3 (0.46) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL9770735 0.93 HSD17B2 (0.47) ACHEHSD17B2HSD17B1MAOBMTNR1A
SCHEMBL10042852 0.93 MTNR1A (0.52) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL9915643 0.92 ACHE (0.56) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL14340638 0.92 ACHE (0.50) ACHEADRA2AADRA1AADRA2BADRA2C
SCHEMBL9581154 0.91 ALKBH3 (0.48) ACHEADRA2AADRA1AHSD17B2HSD17B1
SCHEMBL12018970 0.90 PGR (0.46) ACHEADRA2AADRA1AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673792-B2 p-Terphenyl compound mixture and electrophotographic photoreceptors made by using the same HODOGAYA CHEMICAL CO., LTD. (JP) 2014-03-18 US disclosed
US-20130280652-A1 P-TERPHENYL COMPOUND MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTORS MADE BY USING THE SAME HODOGAYA CHEMICAL CO LTD (JP) 2013-10-24 US disclosed
US-8486594-B2 P-terphenyl compound mixture and electrophotographic photoreceptors made by using the same HODOGAYA CHEMICAL CO., LTD. (JP) 2013-07-16 US disclosed
US-8486594-B2 P-terphenyl compound mixture and electrophotographic photoreceptors made by using the same HODOGAYA CHEMICAL CO., LTD. (JP) 2013-07-16 US disclosed
US-20090053633-A1 P-TERPHENYL COMPOUND MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTORS MADE BY USING THE SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed
US-20090053633-A1 P-TERPHENYL COMPOUND MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTORS MADE BY USING THE SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2009-02-26 US disclosed
EP-1995234-A1 p-TERPHENYL COMPOUND MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTORS MADE BY USING THE SAME Hodogaya Chemical Co., Ltd. (JP) 2008-11-26 EP disclosed