SCHEMBL25972995

SCHEMBL25972995

Fc1cc(NCCCCNCC2CCCN2)c(Cl)cc1SNc1nccs1

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.69
SCN1A P35498 1/20 0.69
CYP3A4 P08684 10/20 0.51
SCN5A Q14524 10/20 0.40

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
SCHEMBL25974872 1.00 SCN9A (0.69) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL25974852 0.97 SCN9A (0.66) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL20182512 0.97 SCN9A (0.65) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL20182515 0.93 SCN9A (0.60) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL19001234 0.93 SCN9A (0.60) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL25973550 0.90 SCN9A (0.58) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL25973514 0.87 SCN9A (0.54) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL25973524 0.87 SCN9A (0.54) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL25973567 0.87 SCN9A (0.54) SCN9ASCN1ACYP3A4SCN5A
SCHEMBL20115642 0.86 SCN9A (0.68) SCN9ASCN1ACYP3A4SCN5A

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 2 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