SCHEMBL6686937

SCHEMBL6686937

Cc1ccccc1C=CC(N)CC(=O)N1CCC[C@H]1C#N

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.55
DPP8 Q6V1X1 14/20 0.55
DPP9 Q86TI2 6/20 0.55
FAP Q12884 5/20 0.55
DPP7 Q9UHL4 6/20 0.48
PREP P48147 1/20 0.46

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
SCHEMBL6686938 1.00 DPP4 (0.55) DPP4DPP8DPP9FAPDPP7
SCHEMBL6692159 0.83 DPP4 (0.56) DPP4DPP8DPP9FAPDPP7
SCHEMBL6688077 0.82 DPP4 (0.48) DPP4DPP8DPP9FAPDPP7
SCHEMBL6691637 0.80 DPP4 (0.45) DPP4DPP8DPP9FAPPREP
SCHEMBL6691632 0.80 DPP4 (0.45) DPP4DPP8DPP9FAPPREP
SCHEMBL6691626 0.80 DPP4 (0.45) DPP4DPP8DPP9FAPPREP
SCHEMBL6690147 0.79 DPP4 (0.59) DPP4DPP8DPP9FAPDPP7
SCHEMBL6688053 0.76 DPP4 (0.64) DPP4DPP8DPP9FAPDPP7
SCHEMBL6692174 0.73 DPP4 (0.58) DPP4DPP8DPP9FAPDPP7
SCHEMBL6692175 0.73 DPP4 (0.53) DPP4DPP8DPP9FAPDPP7

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