SCHEMBL7562153

SCHEMBL7562153

CCN(CC)Cc1cc(CCO)cc(-n2nc3ccc(Cl)cc3n2)c1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 4/20 0.37
CYP1A2 P05177 3/20 0.37
KCNH2 Q12809 3/20 0.37
APP P05067 2/20 0.37
NR4A2 P43354 2/20 0.37
ABCB11 O95342 1/20 0.37
CHRM2 P08172 1/20 0.37
HTR1A P08908 1/20 0.37
CHRM1 P11229 1/20 0.37
DRD2 P14416 1/20 0.37
ADRA2C P18825 1/20 0.37
SLC6A2 P23975 1/20 0.37
PTGS2 P35354 1/20 0.37
OPRM1 P35372 1/20 0.37
HTR2B P41595 1/20 0.37
CYP2J2 P51589 1/20 0.37
SLC6A3 Q01959 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
CYP2C8 P10632 2/20 0.36
CYP2C9 P11712 2/20 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
SCHEMBL7566048 0.88 NPC1 (0.40) OPRM1TDP1BCHENPC1RAB9A
SCHEMBL75316 0.85 NPC1 (0.36) CYP2C9CYP2C19CYP3A4HIF1ANPC1
SCHEMBL7736247 0.82 CYP2D6 (0.33) CYP2D6CYP1A2KCNH2APPNR4A2
SCHEMBL7563690 0.81 BCHE (0.44) CYP2D6CYP1A2KCNH2CHRM2HTR1A
SCHEMBL13700429 0.81 NPC1 (0.42) PTGS2NPC1RAB9AKDM4EPOLB
SCHEMBL7570222 0.81 BCHE (0.49) KCNH2CHRM2HTR1ACHRM1SLC6A2
SCHEMBL4949050 0.79 ADORA3 (0.39) NPC1RAB9AMEN1MAPTKMT2A
SCHEMBL13700471 0.79 ERN1 (0.36) TDP1NPC1RAB9ACDK1KDM4E
SCHEMBL74862 0.79 NPC1 (0.35) CYP2C9CYP2C19CYP3A4HIF1ANPC1
SCHEMBL29756256 0.79 ADORA3 (0.39) NPC1RAB9AMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0855393-B1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KK (JP) 2002-08-14 EP disclosed
US-5922882-A ULTRAVIOLET RADIATION ABSORBER; COPOLYMERIZATION COMPONENT OF BISBENZOTRIAZOLE COMPRISING A COPOLYCARBONATE, A COPOLYESTER, A COPOLYURETHANE AND A COPOLYURETHANEURA OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1999-07-13 US disclosed
EP-0855393-A1 BISBENZOTRIAZOLYLPHENOLS OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1998-07-29 EP disclosed