SCHEMBL21783407

SCHEMBL21783407

Fc1cccc(NSc2cnc(NCc3c(F)cccc3CN3CCCC3)c(Cl)c2)n1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 20/20 0.69
SCN5A Q14524 20/20 0.69
SCN8A Q9UQD0 20/20 0.69
NR1I2 O75469 1/20 0.43
SCN1B Q07699 1/20 0.43

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
SCHEMBL31017735 0.82 SCN1A (1.00) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783404 0.82 SCN1A (1.00) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783491 0.78 SCN1A (0.69) SCN1ASCN5ASCN8A
SCHEMBL20256504 0.78 SCN1A (0.68) SCN1ASCN5ASCN8A
Trifluoroacetic Acid SCHEMBL21955461 0.77 SCN1A (0.88) SCN1ASCN5ASCN8ANR1I2SCN1B
Trifluoroacetic Acid SCHEMBL30046859 0.77 SCN1A (0.88) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783332 0.76 SCN1A (0.70) SCN1ASCN5ASCN8A
SCHEMBL21783450 0.76 SCN1A (0.68) SCN1ASCN5ASCN8A
SCHEMBL21783396 0.75 SCN1A (0.68) SCN1ASCN5ASCN8A
SCHEMBL20256352 0.71 SCN1A (0.68) SCN1ASCN5ASCN8ANR1I2SCN1B

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