SCHEMBL3947722

SCHEMBL3947722

CC(NC(=O)c1cccc(-c2ccc(C(=O)O)cc2)c1)[C@@H](C)C(=O)N1CC[C@](O)(c2ccc(Cl)cc2)C(C)(C)C1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 20/20 0.77

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
SCHEMBL3949892 0.92 CCR1 (0.72) CCR1
SCHEMBL2160565 0.90 CCR1 (0.84) CCR1
SCHEMBL3007113 0.87 CCR1 (1.00) CCR1
SCHEMBL3943809 0.87 CCR1 (1.00) CCR1
SCHEMBL3007118 0.87 CCR1 (1.00) CCR1
SCHEMBL3943738 0.87 CCR1 (0.81) CCR1
SCHEMBL12399229 0.86 CCR1 (0.92) CCR1
SCHEMBL3945242 0.86 CCR1 (0.80) CCR1
SCHEMBL3941789 0.86 CCR1 (0.80) CCR1
SCHEMBL12399850 0.86 CCR1 (0.85) CCR1

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-2049486-A2 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Bristol-Myers Squibb Company (US) 2009-04-22 EP disclosed
WO-2007092681-A2 PIPERIDINYL DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2007-08-16 WO disclosed