SCHEMBL16319684

SCHEMBL16319684

COc1cc(Cl)ccc1Oc1ccc(C(=O)NS(C)(=O)=O)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 18/20 0.58
SCN5A Q14524 2/20 0.52
FLT1 P17948 1/20 0.50
FLT4 P35916 1/20 0.50
KDR P35968 1/20 0.50
SCN8A Q9UQD0 1/20 0.50
SCN10A Q9Y5Y9 1/20 0.50

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
SCHEMBL16319923 0.90 FLT1 (0.59) SCN9AFLT1FLT4KDR
SCHEMBL16319754 0.85 SCN9A (0.62) SCN9ASCN5ASCN8ASCN10A
SCHEMBL16319410 0.85 SCN9A (0.56) SCN9ASCN5AFLT1FLT4KDR
SCHEMBL16319563 0.84 SCN9A (0.61) SCN9ASCN5A
SCHEMBL16319420 0.83 FLT1 (0.52) SCN9AFLT1FLT4KDR
SCHEMBL678799 0.82 SCN9A (0.56) SCN9ASCN5A
SCHEMBL16319554 0.81 SCN9A (0.62) SCN9ASCN5ASCN8ASCN10A
SCHEMBL16319335 0.80 SCN9A (0.61) SCN9ASCN5A
SCHEMBL16319471 0.80 SCN9A (0.63) SCN9ASCN5A
SCHEMBL16319522 0.80 SCN9A (0.60) SCN9ASCN5A

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-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed