SCHEMBL19415744

SCHEMBL19415744

O=S(=O)(Nc1ccc(Cl)cc1NS(=O)(=O)c1cc2ccccc2o1)c1ccc(Oc2cc(-c3c(S(=O)(=O)Nc4cc(Cl)ccc4NS(=O)(=O)c4ccc(Oc5ccccn5)cc4)oc4ccccc34)ccc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 20/20 0.46

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
SCHEMBL9930713 0.86 CCR2 (0.58) CCR2
SCHEMBL9930815 0.79 CCR2 (0.67) CCR2
SCHEMBL9930975 0.75 CCR2 (0.63) CCR2
SCHEMBL9930679 0.75 CCR2 (0.66) CCR2
SCHEMBL9930460 0.75 CCR2 (0.58) CCR2
SCHEMBL9931229 0.74 CCR2 (0.59) CCR2
SCHEMBL9931098 0.73 CCR2 (0.71) CCR2
SCHEMBL9931271 0.72 CCR2 (0.58) CCR2
SCHEMBL9930968 0.72 CCR2 (0.69) CCR2
SCHEMBL9930574 0.72 CCR2 (0.55) CCR2

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-2955173-B1 1,2-BIS-SULFONAMIDE DERIVATIVES AS CHEMOKINE RECEPTOR MODULATORS ALLERGAN INC (US) 2017-10-04 EP disclosed