SCHEMBL14520437

SCHEMBL14520437

C=C(C)N1CCn2nc(C(F)(F)F)nc2C1CC(=O)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 13/20 0.39
DPP7 Q9UHL4 12/20 0.39
DPP8 Q6V1X1 5/20 0.39
DPP9 Q86TI2 5/20 0.39

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
SCHEMBL13677340 0.85 DPP4 (0.38) DPP4DPP7DPP8DPP9
SCHEMBL13676979 0.81 DPP4 (0.38) DPP4DPP7DPP8DPP9
SCHEMBL5233718 0.74 DPP4 (0.35) DPP4DPP7DPP8DPP9
SCHEMBL5228676 0.68 DPP4 (0.41) DPP4DPP7DPP8DPP9
SCHEMBL5227629 0.64 DPP4 (0.37) DPP4DPP7DPP8DPP9
SCHEMBL13563255 0.51 DPP4 (0.39) DPP4DPP7DPP8
SCHEMBL13624977 0.50 GAA (0.30)
SCHEMBL22590473 0.49 DPP4 (0.38) DPP4DPP7DPP8
SCHEMBL11324356 0.49
SCHEMBL12903289 0.49

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-2007070173-A2 CETP INHIBITORS MERCK & CO., INC. (US) 2007-06-21 WO disclosed