SCHEMBL7834178

SCHEMBL7834178

Clc1cccc(Cl)c1OCc1nc2ccc(-n3ccnc3)cc2[nH]1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 1/20 0.52
FGFR1 P11362 1/20 0.46
FLT1 P17948 1/20 0.46
F9 P00740 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
RAB9A P51151 2/20 0.44
IDO1 P14902 1/20 0.42
CYP19A1 P11511 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
BRS3 P32247 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
NPC1 O15118 1/20 0.38
POLB P06746 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRA2 P47869 1/20 0.38
NOTUM Q6P988 1/20 0.37

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
Hydrochloric Acid SCHEMBL8157014 0.99 CBFB (0.51) CBFBFGFR1FLT1F9NCOA3
SCHEMBL7834174 0.92 F9 (0.44) CBFBFGFR1FLT1F9NCOA3
Hydrochloric Acid SCHEMBL8157010 0.91 F9 (0.44) CBFBFGFR1FLT1F9NCOA3
SCHEMBL7833044 0.87 CBFB (0.52) CBFBFGFR1FLT1F9NCOA3
SCHEMBL7832655 0.87 CBFB (0.52) CBFBFGFR1FLT1F9NCOA3
Hydrochloric Acid SCHEMBL8155878 0.86 CBFB (0.51) CBFBFGFR1FLT1F9NCOA3
SCHEMBL7830709 0.85 CBFB (0.50) CBFBFGFR1FLT1F9NCOA3
SCHEMBL7834717 0.85 CBFB (0.49) CBFBFGFR1FLT1F9NCOA3
Hydrochloric Acid SCHEMBL7821802 0.85 CBFB (0.49) CBFBFGFR1FLT1F9NCOA3
SCHEMBL7832662 0.85 CBFB (0.49) CBFBFGFR1FLT1F9NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0894795-B1 Benzimidazole, benzoxazole and benzothiazole derivatives, their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-06-06 EP disclosed
EP-0894795-A1 Benzimidazole, benzoxazole and benzothiazole derivatives, their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-02-03 EP disclosed