SCHEMBL16635392

SCHEMBL16635392

COc1nc(C(F)(F)F)ccc1-c1cc(F)cc(CNC(=O)C2CC(F)CN2S(=O)(=O)c2ccc(F)cc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 20/20 1.00

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
SCHEMBL16647868 1.00 TRPA1 (1.00) TRPA1
SCHEMBL16648082 0.94 TRPA1 (0.89) TRPA1
SCHEMBL16648012 0.92 TRPA1 (1.00) TRPA1
SCHEMBL16648072 0.91 TRPA1 (0.88) TRPA1
SCHEMBL20113070 0.88 TRPA1 (0.78) TRPA1
SCHEMBL16647837 0.83 TRPA1 (1.00) TRPA1
SCHEMBL16635097 0.83 TRPA1 (1.00) TRPA1
SCHEMBL16635176 0.82 TRPA1 (1.00) TRPA1
SCHEMBL16647869 0.82 TRPA1 (1.00) TRPA1
SCHEMBL16634900 0.81 TRPA1 (1.00) TRPA1

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-3055302-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS F. Hoffmann-La Roche AG (CH) 2016-08-17 EP disclosed
WO-2015052264-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2015-04-16 WO disclosed