SCHEMBL5570689

SCHEMBL5570689

NC(CC(=O)N1CC(n2cccn2)C1)Cc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.54
DPP7 Q9UHL4 5/20 0.54
DPP8 Q6V1X1 3/20 0.48
DPP9 Q86TI2 1/20 0.44

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
SCHEMBL4954853 1.00 DPP4 (0.54) DPP4DPP7DPP8DPP9
SCHEMBL4957718 0.79 SCN9A (0.44)
SCHEMBL4957710 0.79 SCN9A (0.44)
SCHEMBL14307565 0.78 DPP4 (0.35) DPP4DPP7DPP8DPP9
SCHEMBL5188904 0.76 DPP4 (0.53) DPP4DPP7DPP8DPP9
SCHEMBL4917079 0.76 DPP4 (0.53) DPP4DPP7DPP8DPP9
SCHEMBL8474386 0.76 DPP4 (0.65) DPP4DPP7DPP8DPP9
SCHEMBL14006817 0.75 DPP4 (0.71) DPP4DPP7DPP8
SCHEMBL4954727 0.75 DPP4 (0.55) DPP4DPP7DPP8
SCHEMBL8483179 0.75 DPP4 (0.67) DPP4DPP7DPP8DPP9

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-1786806-A1 DPP-IV INHIBITORS Santhera Pharmaceuticals (Schweiz) AG (CH) 2007-05-23 EP disclosed
WO-2005121131-A1 DPP-IV INHIBITORS SANTHERA PHARMACEUTICALS (SCHWEIZ) AG (CH) 2005-12-22 WO disclosed