SCHEMBL14535255

SCHEMBL14535255

N[C@@H](CC(=O)N1CCC[C@H]1CO)Cc1ccccc1F

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.77
DPP8 Q6V1X1 3/20 0.77
DPP7 Q9UHL4 2/20 0.69
DPP9 Q86TI2 1/20 0.69

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
SCHEMBL14421644 0.91 DPP4 (0.74) DPP4DPP8DPP7DPP9
SCHEMBL8377886 0.88 DPP4 (0.94) DPP4DPP8DPP7DPP9
SCHEMBL8377973 0.88 DPP4 (0.94) DPP4DPP8DPP7DPP9
SCHEMBL7858456 0.88 DPP4 (0.94) DPP4DPP8DPP7DPP9
SCHEMBL7852579 0.88 DPP4 (0.94) DPP4DPP8DPP7DPP9
SCHEMBL8289074 0.87 DPP4 (0.68) DPP4DPP8DPP7DPP9
SCHEMBL4664756 0.87 DPP4 (0.68) DPP4DPP8DPP7DPP9
SCHEMBL4958143 0.85 DPP4 (0.76) DPP4DPP8DPP7DPP9
SCHEMBL7852588 0.85 DPP4 (0.73) DPP4DPP8DPP7DPP9
SCHEMBL8290050 0.85 DPP4 (0.69) DPP4DPP8DPP7DPP9

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-2007053819-A2 PYRROLIDINYL BETA-AMINO AMIDE-BASED INHIBITORS OF DIPEPTIDYL PEPTIDASE IV AND METHODS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-10 WO disclosed