SCHEMBL17090393

SCHEMBL17090393

Cc1cc(NCCC(C)CCNS(=O)(=O)C(C)C)ccc1N1CCC(O)(c2ccc(Cl)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 19/20 0.41

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
SCHEMBL13565246 0.90 CCR1 (0.45) CCR1
SCHEMBL17090391 0.89 CCR1 (0.41) CCR1
SCHEMBL12882342 0.88 CCR1 (0.39) CCR1
SCHEMBL13565164 0.87 CCR1 (0.42) CCR1
SCHEMBL10115415 0.82 CCR1 (0.43) CCR1
SCHEMBL13565837 0.82 CCR1 (0.38) CCR1
SCHEMBL12882823 0.82 MCHR1 (0.38) CCR1
SCHEMBL17090383 0.79 NPY5R (0.41) CCR1
SCHEMBL13565102 0.79 NPY5R (0.41) CCR1
SCHEMBL11935603 0.78 CCR1 (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 US disclosed