SCHEMBL21783348

SCHEMBL21783348

Cc1nc(NCc2c(F)cccc2CN(C)C(C)(C)C)ccc1SN(C(=O)OC(C)(C)C)c1cscn1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 20/20 0.61
SCN1A P35498 19/20 0.61
SCN5A Q14524 19/20 0.61
NR1I2 O75469 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
SCN1B Q07699 1/20 0.49
KCNH2 Q12809 1/20 0.49
SCN9A Q15858 1/20 0.49
SCN2A Q99250 1/20 0.49

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
SCHEMBL21783344 0.84 SCN8A (0.68) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL30046056 0.84 SCN8A (0.68) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL21783353 0.83 SCN8A (0.58) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL21783518 0.81 SCN8A (0.59) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL20256689 0.81 SCN8A (0.49) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL21783352 0.80 SCN8A (0.71) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL21778030 0.80 SCN8A (0.70) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL21783340 0.77 SCN8A (0.32) SCN8A
SCHEMBL20252564 0.76 SCN8A (0.66) SCN8ASCN1ASCN5ANR1I2CYP1A2
SCHEMBL21783349 0.76 SCN8A (1.00) SCN8ASCN1ASCN5ANR1I2CYP1A2

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