SCHEMBL2659958

SCHEMBL2659958

CC(OCc1cccc(-n2cnc3c[c]ccc32)c1)c1ncc[nH]1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 2/20 0.35
FGFR1 P11362 11/20 0.35
SRC P12931 3/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRA2 P47869 1/20 0.31

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
SCHEMBL2977950 0.84 FGFR1 (0.39) PRKCIFGFR1SRCMAPK1SMN1; SMN2
SCHEMBL2974092 0.83 FGFR1 (0.38) PRKCIFGFR1SRCMAPK1SMN1; SMN2
SCHEMBL2976805 0.83 PRKCI (0.44) PRKCIFGFR1SRCMAPK1SMN1; SMN2
SCHEMBL2966390 0.81 FGFR1 (0.44) PRKCIFGFR1SRCMAPK1SMN1; SMN2
SCHEMBL2963434 0.81 SIGMAR1 (0.38) FGFR1SMN1; SMN2GABRA1GABRG2GABRB3
SCHEMBL2652696 0.80 FGFR1 (0.36) PRKCIFGFR1SRCMAPK1SMN1; SMN2
SCHEMBL2964600 0.78 HPGD (0.45) FGFR1MAPK1SMN1; SMN2GABRA1GABRG2
SCHEMBL2968176 0.71 MAOB (0.39)
SCHEMBL27984245 0.70 TAAR1 (0.44) MAPK1SMN1; SMN2
SCHEMBL28722140 0.70 HPGD (0.54) FGFR1SMN1; SMN2

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-1874758-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2008-01-09 EP disclosed
WO-2006111516-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2006-10-26 WO disclosed