SCHEMBL1958017

SCHEMBL1958017

CC(C(F)F)[C@]1(Oc2ncc(S(N)(=O)=O)cc2Cl)CCNC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.31
SCN9A Q15858 1/20 0.31

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
SCHEMBL1870366 0.82 SCN9A (0.32) SCN9A
SCHEMBL1865903 0.76
SCHEMBL1700364 0.71 SCN9A (0.33) SCN9A
SCHEMBL1959260 0.70 IRAK4 (0.38) SCN5ASCN9A
SCHEMBL1863585 0.70 SOS1 (0.35) SCN5ASCN9A
SCHEMBL1700611 0.65 SCN9A (0.43) SCN5ASCN9A
Trifluoroacetic Acid SCHEMBL1700071 0.65 IRAK4 (0.37) SCN5ASCN9A
SCHEMBL29629045 0.64 IKBKB (0.50) SCN9A
SCHEMBL1700623 0.64 SCN9A (0.39) SCN5ASCN9A
SCHEMBL1700491 0.64 CA2 (0.39)

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-2507229-A1 SULFONAMIDE DERIVATIVES AS BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES Abbott Laboratories (US) 2012-10-10 EP disclosed
WO-2011068561-A1 SULFONAMIDE DERIVATIVES AS BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-06-09 WO disclosed