SCHEMBL19634178

SCHEMBL19634178

CC(c1ccccc1)N1CCC(Oc2cc(F)c([S+]([O-])Nc3cscn3)c(F)c2)CC1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 20/20 0.69
SCN1A P35498 15/20 0.56

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
SCHEMBL19634065 0.83 SCN8A (0.70) SCN8ASCN1A
SCHEMBL19613714 0.82 SCN8A (1.00) SCN8ASCN1A
SCHEMBL19613716 0.82 SCN8A (1.00) SCN8ASCN1A
Trifluoroacetic Acid SCHEMBL19614267 0.77 SCN8A (0.89) SCN8ASCN1A
Trifluoroacetic Acid SCHEMBL19614264 0.77 SCN8A (0.89) SCN8ASCN1A
SCHEMBL19634151 0.73 SCN8A (0.70) SCN8ASCN1A
SCHEMBL19634024 0.73 SCN8A (0.70) SCN8ASCN1A
SCHEMBL19634187 0.72 SCN8A (0.70) SCN8ASCN1A
SCHEMBL19613017 0.72 SCN8A (0.67) SCN8ASCN1A
SCHEMBL19613020 0.72 SCN8A (0.67) 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