SCHEMBL185657

SCHEMBL185657

COc1cccc2c1c(-c1ccsc1S(N)(=O)=O)nn2Cc1cccc(S(=O)(=O)N(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCR4 P51679 19/20 0.41
GAA P10253 1/20 0.36

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
SCHEMBL185246 0.84 BUB1 (0.42) CCR4
SCHEMBL185344 0.84 CCR4 (0.43) CCR4
SCHEMBL186059 0.83 CCR4 (0.51) CCR4
SCHEMBL186961 0.82 CCR4 (0.44) CCR4
SCHEMBL185375 0.82 CCR4 (0.43) CCR4
SCHEMBL186309 0.81 CCR4 (0.49) CCR4GAA
SCHEMBL186057 0.79 CCR4 (0.49) CCR4
SCHEMBL185658 0.76 CCR4 (0.58) CCR4
SCHEMBL186311 0.74 GRIN1 (0.42) CCR4
SCHEMBL358265 0.71 CCR4 (0.78) CCR4

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-2401270-A1 PYRAZOLE DERIVATIVES USED AS CCR4 RECEPTOR ANTAGONISTS Glaxo Group Limited (GB) 2012-01-04 EP disclosed