SCHEMBL5617484

SCHEMBL5617484

O=C(O)c1cn2c(n1)CN(C(=O)C[C@H]([AsH2])Cc1cc(F)ccc1F)CC2

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.50
DPP8 Q6V1X1 19/20 0.50
DPP7 Q9UHL4 8/20 0.45
DPP9 Q86TI2 8/20 0.45

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
SCHEMBL5617487 1.00 DPP4 (0.50) DPP4DPP8DPP7DPP9
SCHEMBL5489214 0.90 DPP4 (0.63) DPP4DPP8DPP7DPP9
SCHEMBL5492467 0.83 DPP4 (0.62) DPP4DPP8DPP7DPP9
SCHEMBL5615517 0.83 DPP4 (0.62) DPP4DPP8DPP7DPP9
SCHEMBL5935826 0.81 DPP4 (0.44) DPP4DPP8DPP7DPP9
SCHEMBL5492693 0.79 DPP4 (0.58) DPP4DPP8DPP7DPP9
SCHEMBL1842480 0.78 DPP4 (0.70) DPP4DPP8DPP7DPP9
SCHEMBL1842481 0.78 DPP4 (0.70) DPP4DPP8DPP7DPP9
SCHEMBL8335584 0.78 DPP4 (0.56) DPP4DPP8DPP7DPP9
SCHEMBL8335587 0.77 DPP4 (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1684786-A4 ENHANCEMENT OF GROWTH HORMONE LEVELS WITH A DIPEPTIDYL PEPTIDASE IV INHIBITOR AND A GROWTH HORMONE SECRETAGOGUE MERCK & CO INC (US) 2007-12-12 EP disclosed
EP-1684786-A1 ENHANCEMENT OF GROWTH HORMONE LEVELS WITH A DIPEPTIDYL PEPTIDASE IV INHIBITOR AND A GROWTH HORMONE SECRETAGOGUE Merck & Co., Inc. (US) 2006-08-02 EP disclosed
WO-2005042003-A1 ENHANCEMENT OF GROWTH HORMONE LEVELS WITH A DIPEPTIDYL PEPTIDASE IV INHIBITOR AND A GROWTH HORMONE SECRETAGOGUE MERCK & CO., INC. (US) 2005-05-12 WO disclosed