SCHEMBL6604463

SCHEMBL6604463

N#CC1CC(F)CN1C(=O)CNC1CCN(c2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.80

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.80
DPP8 Q6V1X1 6/20 0.60
DPP9 Q86TI2 6/20 0.60
DPP7 Q9UHL4 6/20 0.60
PREP P48147 4/20 0.59

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
SCHEMBL5215391 1.00 DPP4 (0.80) DPP4DPP8DPP9DPP7PREP
SCHEMBL14587275 1.00 DPP4 (0.80) DPP4DPP8DPP9DPP7PREP
Hydrochloric Acid SCHEMBL5641564 0.99 DPP4 (0.79) DPP4DPP8DPP9DPP7PREP
SCHEMBL5215339 0.90 DPP4 (0.83) DPP4DPP8DPP9DPP7PREP
SCHEMBL5215649 0.89 DPP4 (1.00) DPP4DPP8DPP9DPP7PREP
Hydrochloric Acid SCHEMBL5216724 0.89 DPP4 (0.82) DPP4DPP8DPP9DPP7PREP
SCHEMBL6605407 0.89 DPP4 (1.00) DPP4DPP8DPP9DPP7PREP
Hydrochloric Acid SCHEMBL5218591 0.88 DPP4 (0.98) DPP4DPP8DPP9DPP7PREP
SCHEMBL12921251 0.87 DPP4 (1.00) DPP4DPP8DPP9DPP7PREP
SCHEMBL5218020 0.86 DPP4 (0.76) DPP4DPP8DPP9DPP7PREP

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-1399433-A2 FLUOROPYRROLIDINES AS DIPEPTIDYL PEPTIDASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2004-03-24 EP claimed
WO-2003002553-A2 FLUOROPYRROLIDINES AS DIPEPTIDYL PEPTIDASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-01-09 WO claimed