SCHEMBL19634331

SCHEMBL19634331

COc1ccc(CN(Sc2ccc(OC3CCN(C(C)c4ccccc4)CC3)c(Cl)c2)c2ncc(F)cn2)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 19/20 0.52
SCN1A P35498 11/20 0.40
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL19634144 0.85 SCN8A (0.51) SCN8ASCN1AHRH3
SCHEMBL19613482 0.84 SCN8A (0.62) SCN8ASCN1A
SCHEMBL19613481 0.84 SCN8A (0.62) SCN8ASCN1A
SCHEMBL19627759 0.77 SCN8A (0.63) SCN8ASCN1A
SCHEMBL19634143 0.77 SCN8A (0.51) SCN8ASCN1A
SCHEMBL19633903 0.77 MEN1 (0.40)
SCHEMBL19634035 0.75 SCN8A (0.68) SCN8ASCN1A
SCHEMBL19634053 0.73 SCN8A (0.42) SCN8ASCN1A
SCHEMBL19613505 0.72 SCN8A (0.61) SCN8ASCN1A
SCHEMBL19613503 0.72 SCN8A (0.61) SCN8ASCN1A

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-2017201468-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2017-11-23 WO disclosed