SCHEMBL4373065

SCHEMBL4373065

Cc1onc(C(Cc2ccccc2)NS(=O)(=O)c2ccc(Cl)cc2)c1I

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 15/20 0.56
ADAMTS5 Q9UNA0 1/20 0.47
MMP2 P08253 1/20 0.47
UTS2R Q9UKP6 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41

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
SCHEMBL4156956 1.00 S1PR1 (0.56) S1PR1ADAMTS5MMP2UTS2RCA2
SCHEMBL13875328 0.89 S1PR1 (0.58) S1PR1ADAMTS5MMP2UTS2R
SCHEMBL4159021 0.87 S1PR1 (0.56) S1PR1ADAMTS5MMP2UTS2R
SCHEMBL4384846 0.86 S1PR1 (0.59) S1PR1ADAMTS5MMP2
SCHEMBL4168401 0.86 S1PR1 (0.59) S1PR1ADAMTS5MMP2
SCHEMBL4169110 0.85 S1PR1 (0.53) S1PR1ADAMTS5MMP2UTS2RCA2
SCHEMBL4166457 0.83 S1PR1 (0.52) S1PR1ADAMTS5MMP2UTS2RCA2
SCHEMBL4164065 0.79 S1PR1 (0.60) S1PR1MMP2CA2
SCHEMBL4165496 0.78 S1PR1 (0.52) S1PR1ADAMTS5MMP2
SCHEMBL4363505 0.78 S1PR1 (0.58) S1PR1ADAMTS5MMP2

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-2013184-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS AstraZeneca AB (SE) 2009-01-14 EP disclosed
WO-2007129019-A1 SULFONAMIDE COMPOUNDS USEFUL AS EDG RECEPTOR MODULATORS ASTRAZENECA AB (SE) 2007-11-15 WO disclosed