SCHEMBL21783508

SCHEMBL21783508

COc1ccc(CN(Sc2cc(C)c(NCc3c(F)cccc3CN3CCC3)cn2)c2cccc(F)n2)c(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 19/20 0.52
SCN8A Q9UQD0 19/20 0.52
SCN5A Q14524 18/20 0.52

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
SCHEMBL20256961 0.85 SCN1A (0.50) SCN1ASCN8ASCN5A
SCHEMBL21783507 0.85 SCN1A (0.60) SCN1ASCN8ASCN5A
SCHEMBL21783367 0.81 SCN1A (0.54) SCN1ASCN8ASCN5A
SCHEMBL21783377 0.79 MEN1 (0.37)
SCHEMBL21955502 0.78 SCN1A (0.48) SCN1ASCN8ASCN5A
SCHEMBL20256538 0.78 SCN1A (0.48) SCN1ASCN8ASCN5A
SCHEMBL20256553 0.77 SCN1A (0.52) SCN1ASCN8ASCN5A
SCHEMBL20256656 0.77 SCN1A (0.53) SCN1ASCN8ASCN5A
SCHEMBL21783480 0.76 SCN8A (0.51) SCN1ASCN8ASCN5A
SCHEMBL20238858 0.75 SCN1A (0.58) SCN1ASCN8ASCN5A

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-2020047323-A1 HETEROARYL-SUBSTITUTED SULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2020-03-05 WO disclosed