SCHEMBL9868635

SCHEMBL9868635

Clc1ccc(-c2nc3cccnc3o2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.54
KDM4E B2RXH2 3/20 0.54
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
TP53 P04637 2/20 0.54
HSD17B10 Q99714 2/20 0.54
ALDH1A1 P00352 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAOB P27338 3/20 0.54
NPSR1 Q6W5P4 2/20 0.47
MAPT P10636 1/20 0.47
SGMS2 Q8NHU3 4/20 0.47
ACHE P22303 1/20 0.44
CASP3 P42574 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
ADRB2 P07550 1/20 0.44
ADK P55263 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL27200963 0.98 HPGD (0.53) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL13998685 0.90 ALDH1A1 (0.59) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL13998715 0.86 HPGD (0.57) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL12910410 0.85 HPGD (0.56) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL9867688 0.84 SGMS2 (0.55) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL24454863 0.83 RAB9A (0.58) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL29686704 0.83 RAB9A (0.58) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL30787109 0.83 RAB9A (0.54) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL2244448 0.83 NPC1 (0.58) HPGDKDM4ENPC1RAB9ATP53
SCHEMBL4148452 0.83 RAB9A (0.54) HPGDKDM4ENPC1RAB9ATP53

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-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed