SCHEMBL2903645

SCHEMBL2903645

O=C(C=Cc1ccc(Cl)c(Cl)c1)N1CCC(=O)N(CCCN2CCC(c3ccccc3)CC2)CC1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 16/20 0.61
SLC2A1 P11166 2/20 0.53
GPR183 P32249 2/20 0.52

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
SCHEMBL2903643 1.00 CCR2 (0.61) CCR2SLC2A1GPR183
SCHEMBL2903110 0.89 CCR2 (0.54) CCR2SLC2A1GPR183
SCHEMBL2904719 0.89 CCR2 (0.54) CCR2SLC2A1GPR183
SCHEMBL2904715 0.89 CCR2 (0.54) CCR2SLC2A1GPR183
SCHEMBL2903112 0.89 CCR2 (0.54) CCR2SLC2A1GPR183
SCHEMBL2902985 0.88 CCR2 (0.53) CCR2SLC2A1GPR183
SCHEMBL2902982 0.88 CCR2 (0.53) CCR2SLC2A1GPR183
SCHEMBL2904879 0.87 CCR2 (0.56) CCR2SLC2A1GPR183
SCHEMBL2904880 0.87 CCR2 (0.56) CCR2SLC2A1GPR183
SCHEMBL2899723 0.87 CCR2 (0.54) CCR2SLC2A1GPR183

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-2010506-B1 DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS HOFFMANN LA ROCHE (CH) 2010-08-04 EP disclosed