SCHEMBL7257702

SCHEMBL7257702

CCC(CC)(CC)C(N)C(=O)N1CC=CC1C#N

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.48
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
FAP Q12884 1/20 0.33

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
SCHEMBL6172382 1.00 DPP4 (0.48) DPP4DPP8DPP9FAP
SCHEMBL6172387 1.00 DPP4 (0.48) DPP4DPP8DPP9FAP
SCHEMBL5958085 0.85 DPP4 (0.52) DPP4DPP8DPP9FAP
SCHEMBL464954 0.85 DPP4 (0.52) DPP4DPP8DPP9FAP
SCHEMBL464955 0.85 DPP4 (0.52) DPP4DPP8DPP9FAP
SCHEMBL7178928 0.82 DPP4 (0.41) DPP4DPP8DPP9FAP
SCHEMBL7178931 0.82 DPP4 (0.41) DPP4DPP8DPP9FAP
SCHEMBL6174600 0.82 DPP4 (0.40) DPP4DPP8DPP9FAP
SCHEMBL6174604 0.82 DPP4 (0.40) DPP4DPP8DPP9FAP
SCHEMBL7189181 0.82 DPP4 (0.40) DPP4DPP8DPP9FAP

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-2003057144-A2 CHANGE INHIBITORS OF DIPEPTIDYL PEPTIDASE IV GUILFORD PHARMACEUTICALS (US) 2003-07-17 WO disclosed