SCHEMBL16908765

SCHEMBL16908765

CCN(C(=O)O)C1CCC(N2CC(NC(=O)CNc3ncnc4ccc(C(F)(F)F)cc34)C2)CC1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCRL2 O00421 20/20 0.88

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
SCHEMBL16908766 1.00 CCRL2 (0.88) CCRL2
SCHEMBL16908790 0.94 CCRL2 (0.81) CCRL2
SCHEMBL16908789 0.94 CCRL2 (0.81) CCRL2
SCHEMBL12032640 0.94 CCRL2 (1.00) CCRL2
SCHEMBL9999234 0.94 CCRL2 (1.00) CCRL2
SCHEMBL9999235 0.94 CCRL2 (1.00) CCRL2
SCHEMBL16908792 0.89 CCRL2 (0.74) CCRL2
SCHEMBL9999483 0.89 CCRL2 (0.84) CCRL2
SCHEMBL9999478 0.89 CCRL2 (0.84) CCRL2
SCHEMBL9998545 0.89 CCRL2 (1.00) CCRL2

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-2582692-B1 CYCLOHEXYL-AZETIDINYL ANTAGONISTS OF CCR2 JANSSEN PHARMACEUTICA NV (BE) 2015-07-22 EP claimed