SCHEMBL6692159

SCHEMBL6692159

Cc1ccc(C=CC(N)CC(=O)N2CCC[C@H]2C#N)cc1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.56
DPP8 Q6V1X1 9/20 0.56
DPP9 Q86TI2 6/20 0.56
DPP7 Q9UHL4 6/20 0.56
FAP Q12884 4/20 0.56
PREP P48147 2/20 0.44

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
SCHEMBL6690147 0.89 DPP4 (0.59) DPP4DPP8DPP9DPP7FAP
SCHEMBL6688077 0.88 DPP4 (0.48) DPP4DPP8DPP9DPP7FAP
SCHEMBL6686938 0.83 DPP4 (0.55) DPP4DPP8DPP9DPP7FAP
SCHEMBL6686937 0.83 DPP4 (0.55) DPP4DPP8DPP9DPP7FAP
SCHEMBL6689344 0.81 DPP4 (0.45) DPP4DPP8DPP9DPP7FAP
SCHEMBL6686150 0.79 DPP4 (0.44) DPP4DPP8DPP9DPP7FAP
SCHEMBL6686147 0.79 DPP4 (0.44) DPP4DPP8DPP9DPP7FAP
SCHEMBL6688921 0.77 DPP4 (0.63) DPP4DPP8DPP9DPP7FAP
SCHEMBL6692172 0.74 DPP4 (0.53) DPP4DPP8DPP9DPP7FAP
SCHEMBL6692175 0.74 DPP4 (0.53) DPP4DPP8DPP9DPP7FAP

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
WO-2004089362-A1 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS NOVO NORDISK A/S (DK) 2004-10-21 WO disclosed