SCHEMBL5757482

SCHEMBL5757482

CSc1ccc(S(=O)(=O)CC2C[C@H](N)CCC2NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 18/20 0.57
CTSK P43235 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42

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
SCHEMBL3424689 1.00 CCR2 (0.57) CCR2CTSKMAOAMAOB
SCHEMBL2990164 1.00 CCR2 (0.57) CCR2CTSKMAOAMAOB
SCHEMBL2995627 0.88 CCR2 (0.54) CCR2MAOAMAOB
SCHEMBL5756401 0.87 CCR2 (0.59) CCR2CTSKMAOAMAOB
SCHEMBL2991013 0.87 CCR2 (0.59) CCR2CTSKMAOAMAOB
SCHEMBL5756396 0.87 CCR2 (0.59) CCR2CTSKMAOAMAOB
SCHEMBL2986117 0.86 CCR2 (0.62) CCR2CTSKMAOAMAOB
SCHEMBL2992114 0.85 CCR2 (0.60) CCR2CTSK
SCHEMBL3427293 0.85 CCR2 (0.60) CCR2CTSK
SCHEMBL4415110 0.85 CCR2 (0.46) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483241-A4 CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL MYERS SQUIBB CO (US) 2006-12-13 EP disclosed
EP-1483241-A2 CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2004-12-08 EP disclosed
WO-2003075853-A2 CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2003-09-18 WO disclosed