SCHEMBL21783381

SCHEMBL21783381

Fc1cccc(CN2CCC2)c1CNc1cnc(SNc2cscn2)cc1C(F)(F)F

nearest known ligand 0.74

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 20/20 0.74
SCN5A Q14524 20/20 0.74
SCN8A Q9UQD0 20/20 0.74
NR1I2 O75469 1/20 0.56
SCN1B Q07699 1/20 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
SCHEMBL21783338 0.89 SCN1A (0.72) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783408 0.86 SCN1A (0.72) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783380 0.85 SCN1A (1.00) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL31017711 0.85 SCN1A (1.00) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL20256862 0.82 SCN1A (0.69) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783328 0.82 SCN1A (0.70) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL20256598 0.81 SCN1A (0.70) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL20256808 0.80 SCN1A (0.70) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL21783365 0.80 SCN1A (0.68) SCN1ASCN5ASCN8ANR1I2SCN1B
SCHEMBL20256505 0.80 SCN1A (0.70) 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