SCHEMBL4850993

SCHEMBL4850993

O=C1C(=O)N(Cc2ccc(C(F)(F)F)o2)c2cccc(F)c21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 6/20 0.41
SCN7A Q01118 1/20 0.41
SCN5A Q14524 1/20 0.41
SCN2A Q99250 1/20 0.41
SCN8A Q9UQD0 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.41
CHRM5 P08912 4/20 0.38
GNRHR P30968 4/20 0.35
PTPN1 P18031 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
NR1H2 P55055 2/20 0.33
NR1H3 Q13133 1/20 0.33
CACNA1G O43497 1/20 0.33
CACNA1H O95180 1/20 0.33
CACNA1I Q9P0X4 1/20 0.33

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
SCHEMBL3593665 0.86 SCN9A (0.40) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL3606824 0.86 SCN9A (0.40) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL282029 0.83 SCN9A (0.47) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL2304043 0.81 CHRM5 (0.58) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281757 0.80 CHRM5 (0.60) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL3328870 0.75 SCN9A (0.42) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL281593 0.75 CHRM5 (0.60) CHRM5CA12CA1CA2CA9
SCHEMBL3329555 0.70 SCN9A (0.46) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL27791607 0.69 SCN9A (0.47) SCN9ASCN7ASCN5ASCN2ASCN8A
SCHEMBL18606955 0.68 CACNA1G (0.45) SCN9ASCN7ASCN5ASCN2ASCN8A

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
WO-2008046083-A2 USE OF OXINDOLE COMPOUNDS AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2008-04-17 WO disclosed