SCHEMBL5572258

SCHEMBL5572258

COC(Cl)c1ccc(S(=O)(=O)Nc2cc(Cl)cnc2Br)cc1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 18/20 0.45
CYP2C9 P11712 1/20 0.42
HTT P42858 1/20 0.39

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
SCHEMBL4430954 0.87 CCR2 (0.42) CCR2CYP2C9HTT
SCHEMBL308218 0.83 CCR2 (0.49) CCR2CYP2C9
SCHEMBL306504 0.83 CCR2 (0.60) CCR2CYP2C9
SCHEMBL1436620 0.83 CYP2C9 (0.48) CCR2CYP2C9
SCHEMBL1762387 0.81 CCR2 (0.51) CCR2CYP2C9
SCHEMBL1762426 0.79 CCR2 (0.55) CCR2CYP2C9
SCHEMBL1762410 0.76 CCR2 (0.51) CCR2CYP2C9
SCHEMBL15259953 0.75 CCR2 (0.42) CCR2CYP2C9
SCHEMBL1762391 0.75 CCR2 (0.49) CCR2CYP2C9
SCHEMBL306008 0.75 CCR2 (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1838674-A2 HETEROARYL SULFONAMIDES AND CCR2 ChemoCentryx Inc (US) 2007-10-03 EP disclosed
WO-2006076644-A2 HETEROARYL SULFONAMIDES AND CCR2 CHEMOCENTRYX, INC. (US) 2006-07-20 WO disclosed