SCHEMBL8293140

SCHEMBL8293140

N[C@@H](CC(=O)N1Cc2ccncc2CC1C(=O)NC1CC1)Cc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.49
DPP8 Q6V1X1 3/20 0.44
DPP7 Q9UHL4 6/20 0.44
DPP9 Q86TI2 1/20 0.43

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
SCHEMBL8293158 0.97 DPP4 (0.49) DPP4DPP8DPP7DPP9
SCHEMBL8295415 0.90 TDP1 (0.51) DPP4DPP8DPP7DPP9
SCHEMBL8294713 0.90 TDP1 (0.51) DPP4DPP8DPP7DPP9
SCHEMBL8293177 0.87 DPP4 (0.50) DPP4DPP8DPP7DPP9
SCHEMBL8294435 0.84 SCN9A (0.41)
SCHEMBL6249845 0.84 SCN9A (0.41)
SCHEMBL8294434 0.81 SCN9A (0.41)
SCHEMBL8293185 0.79 TDP1 (0.55) DPP4DPP8DPP7DPP9
SCHEMBL8294408 0.78 TDP1 (0.68) DPP4DPP8DPP7DPP9
SCHEMBL8293131 0.78 DPP4 (0.51) DPP4DPP8DPP7

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-2005056013-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) GMBH (CH) 2005-06-23 WO disclosed