SCHEMBL5530143

SCHEMBL5530143

CC(C)NC(=O)N[C@@H](CC(=O)N1CCC[C@H]1C#N)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 17/20 0.59
DPP8 Q6V1X1 8/20 0.59
DPP7 Q9UHL4 2/20 0.56
PREP P48147 3/20 0.53

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
SCHEMBL5529957 0.87 DPP4 (0.59) DPP4DPP8DPP7PREP
SCHEMBL6692174 0.79 DPP4 (0.58) DPP4DPP8DPP7PREP
SCHEMBL713741 0.77 DPP4 (0.64) DPP4DPP8DPP7PREP
SCHEMBL719969 0.77 DPP4 (0.64) DPP4DPP8DPP7PREP
SCHEMBL3554544 0.74 DPP4 (1.00) DPP4DPP8DPP7PREP
SCHEMBL3554547 0.74 DPP4 (1.00) DPP4DPP8DPP7PREP
SCHEMBL3546674 0.73 DPP4 (1.00) DPP4DPP8DPP7
SCHEMBL3546678 0.73 DPP4 (1.00) DPP4DPP8DPP7
SCHEMBL14392633 0.73 DPP4 (1.00) DPP4DPP8DPP7
SCHEMBL6685692 0.73 DPP4 (0.46) DPP4DPP8DPP7PREP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1760076-A1 FAP Inhibitors FERRING B.V. (NL) 2007-03-07 EP claimed
EP-1760076-A1 FAP Inhibitors FERRING B.V. (NL) 2007-03-07 EP disclosed