SCHEMBL23913356

SCHEMBL23913356

[O-][S+](Nc1nccs1)c1cc(Cl)c(NCCC2CCCCN2)cc1F

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 12/20 0.66
CYP3A4 P08684 11/20 0.66
SCN1A P35498 1/20 0.50
SCN5A Q14524 9/20 0.45

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
SCHEMBL19000732 0.89 SCN9A (0.65) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL20115628 0.84 SCN9A (0.66) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL20115553 0.84 CYP3A4 (0.64) SCN9ACYP3A4SCN5A
SCHEMBL25974463 0.82 SCN9A (0.59) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL23913399 0.82 SCN9A (0.65) SCN9ACYP3A4SCN5A
SCHEMBL19000629 0.81 SCN9A (0.44) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL20115642 0.81 SCN9A (0.68) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL30479351 0.79 SCN9A (1.00) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL20115644 0.79 SCN9A (1.00) SCN9ACYP3A4SCN1ASCN5A
SCHEMBL22592995 0.79 SCN9A (0.43) SCN9ACYP3A4SCN5A

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
EP-3532462-B1 ACYL SULFONAMIDE NAV1.7 INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2021-10-13 EP disclosed