SCHEMBL8922273

SCHEMBL8922273

O=C(Cl)c1ccc2c(c1)Cc1ccc(C(=O)Cl)cc1C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
SRD5A2 P31213 3/20 0.44
HSD17B1 P14061 1/20 0.43
ALDH1A1 P00352 4/20 0.41
DRD2 P14416 1/20 0.38
ADRA1D P25100 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR7 P34969 1/20 0.38
ADRA1A P35348 1/20 0.38
ADRA1B P35368 1/20 0.38
HTR2B P41595 1/20 0.38
TSHR P16473 1/20 0.37
SRD5A1 P18405 2/20 0.35
CD69 Q07108 1/20 0.35
KCNH2 Q12809 1/20 0.33
TDP2 O95551 1/20 0.33
CTNNB1 P35222 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
SCHEMBL8922280 0.91 ALDH1A1 (0.47) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL9789474 0.89 RAB9A (0.64) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL28438378 0.84 NPC1 (0.53) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL10587731 0.82 ALDH1A1 (0.55) MAPTNPC1RAB9ASRD5A2ALDH1A1
SCHEMBL1700802 0.81 SRD5A2 (0.72) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL28380464 0.79 AHR (0.42) MAPTNPC1RAB9AKDM4E
SCHEMBL28387896 0.79 CRBN (0.42) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL28432070 0.79 NPC1 (0.49) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL6901141 0.79 SRD5A2 (0.66) MAPTNPC1RAB9ASRD5A2HSD17B1
SCHEMBL18585497 0.78 ALDH1A1 (0.68) MAPTNPC1RAB9AALDH1A1CTNNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5670493-A ANGIOGENESIS INHIBITORS ADIR ET COMPAGNIE (FR) 1997-09-23 US disclosed