SCHEMBL6281665

SCHEMBL6281665

Cc1ccc(On2nc(C=Cc3ncc[nH]3)c3ccccc32)cc1N

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL6281660 0.87 CSNK1A1 (0.33)
SCHEMBL5249631 0.71 KDR (0.47)
SCHEMBL11294763 0.60 RAB9A (0.50) NPC1RAB9A
SCHEMBL11294766 0.60 RAB9A (0.50) NPC1RAB9A
SCHEMBL11289761 0.59 NPC1 (0.45) NPC1RAB9A
SCHEMBL11289759 0.59 NPC1 (0.45) NPC1RAB9A
SCHEMBL11299731 0.58 TAAR1 (0.45) NPC1RAB9A
SCHEMBL11299729 0.58 TAAR1 (0.45) NPC1RAB9A
SCHEMBL11291271 0.58 NPC1 (0.51) NPC1RAB9A
SCHEMBL11291273 0.58 NPC1 (0.51) NPC1RAB9A

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-6891044-B2 Indazole compounds and pharmaceutical compositions for Inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-05-10 US disclosed