SCHEMBL7833044

SCHEMBL7833044

Oc1cccc(O)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 2/20 0.46
FLT1 P17948 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.44
F9 P00740 1/20 0.41
ENPP2 Q13822 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
CYP11B1 P15538 3/20 0.40
CYP11B2 P19099 3/20 0.40
CYP19A1 P11511 1/20 0.40
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
RAB9A P51151 1/20 0.39
FGFR2 P21802 1/20 0.37
FGFR3 P22607 1/20 0.37
IDO1 P14902 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 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
SCHEMBL7833040 0.92 CBFB (0.42) CBFBFGFR1FLT1NCOA3F9
SCHEMBL7837226 0.91 CBFB (0.46) CBFBFGFR1FLT1NCOA3F9
SCHEMBL7832655 0.87 CBFB (0.52) CBFBFGFR1FLT1NCOA3F9
SCHEMBL7834178 0.87 CBFB (0.52) CBFBFGFR1FLT1NCOA3F9
Hydrochloric Acid SCHEMBL8155878 0.86 CBFB (0.51) CBFBFGFR1FLT1NCOA3F9
Hydrochloric Acid SCHEMBL8157014 0.86 CBFB (0.51) CBFBFGFR1FLT1NCOA3F9
SCHEMBL7830709 0.85 CBFB (0.50) CBFBFGFR1FLT1NCOA3F9
SCHEMBL7832662 0.85 CBFB (0.49) CBFBFGFR1FLT1NCOA3F9
Hydrochloric Acid SCHEMBL7821802 0.85 CBFB (0.49) CBFBFGFR1FLT1NCOA3F9
SCHEMBL7834717 0.85 CBFB (0.49) CBFBFGFR1FLT1NCOA3F9

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 3 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
US-6040327-A INHIBITORS OF INTERLEUKINS; TREATING RHEUMATOID ARTHRITIS OR ARTHROSIS ADIR ET COMPAGNIE (FR) 2000-03-21 US 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