SCHEMBL11567699

SCHEMBL11567699

O=C(O)c1ccc(Nc2ccc(Br)cc2)nc1

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 15/20 0.73
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
GRM5 P41594 3/20 0.48
HCAR2 Q8TDS4 2/20 0.48
AURKA O14965 1/20 0.48

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
SCHEMBL11564878 0.90 HCAR3 (0.83) HCAR3NPC1RAB9AGRM5HCAR2
SCHEMBL71308 0.85 HCAR3 (1.00) HCAR3NPC1RAB9AGRM5HCAR2
SCHEMBL11561979 0.84 HCAR3 (0.73) HCAR3NPC1RAB9AGRM5
SCHEMBL11563504 0.84 HCAR3 (0.73) HCAR3GRM5
SCHEMBL11564806 0.84 HCAR3 (0.73) HCAR3NPC1RAB9AGRM5HCAR2
SCHEMBL11565571 0.84 HCAR3 (0.73) HCAR3NPC1GRM5HCAR2
SCHEMBL14341697 0.82 HCAR3 (0.76) HCAR3HCAR2
SCHEMBL26436204 0.82 HCAR3 (0.76) HCAR3GRM5HCAR2AURKA
SCHEMBL1520623 0.81 HCAR3 (0.64) HCAR3NPC1RAB9AGRM5HCAR2
SCHEMBL11584100 0.80 HCAR3 (0.68) HCAR3NPC1RAB9AGRM5

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
EP-0000816-A1 Substituted amino-pyridine derivatives, processes for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1979-02-21 EP disclosed