SCHEMBL17090255

SCHEMBL17090255

Cc1cc(N2CC=CC2)ccc1NC[C@H]1CC[C@H](NS(=O)(=O)C(C)C)CC1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 8/20 0.38
BRD4 O60885 6/20 0.37
GRIA2 P42262 4/20 0.36

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
SCHEMBL13564892 1.00 NPY5R (0.38) NPY5RBRD4GRIA2
SCHEMBL17090228 0.88 BRD4 (0.35) NPY5RBRD4GRIA2
SCHEMBL13564885 0.88 BRD4 (0.35) NPY5RBRD4GRIA2
SCHEMBL13564878 0.88 BRD4 (0.35) NPY5RBRD4GRIA2
SCHEMBL11935435 0.83 NPY5R (0.38) NPY5RGRIA2
SCHEMBL13439167 0.83 NPY5R (0.38) NPY5RGRIA2
SCHEMBL17090519 0.82 NPY5R (0.37) NPY5R
SCHEMBL13565112 0.82 NPY5R (0.37) NPY5R
SCHEMBL13439161 0.81 LIPC (0.50) NPY5RGRIA2
SCHEMBL11935425 0.81 LIPC (0.50) NPY5RGRIA2

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