SCHEMBL19000751

SCHEMBL19000751

NCCCCNc1cc(F)c(SNc2nccs2)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 12/20 0.42
SCN9A Q15858 11/20 0.42
CYP3A4 P08684 9/20 0.42
SCN1A P35498 1/20 0.42

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
SCHEMBL22368315 0.95 SCN9A (0.44) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL25973076 0.94 SCN9A (0.45) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL19001187 0.91 SCN9A (0.42) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL19000632 0.90 SCN9A (0.42) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL25974417 0.89 SCN9A (0.39) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL25973018 0.88 SCN9A (0.39) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL25973011 0.88 SCN5A (0.42) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL25973372 0.87 SCN9A (0.43) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL25972987 0.87 SCN9A (0.43) SCN5ASCN9ACYP3A4SCN1A
SCHEMBL19008515 0.87 SCN9A (0.41) SCN5ASCN9ACYP3A4SCN1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3541373-B1 DIAMINO-ALKYLAMINO-LINKED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME LLC (US) 2023-11-01 EP disclosed
EP-3389654-B1 DIAMINO-ALKYLAMINO-LINKED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME LLC (US) 2023-08-16 EP disclosed
WO-2017106409-A1 DIAMINO-ALKYLAMINO-LINKED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME CORP. (US) 2017-06-22 WO disclosed