SCHEMBL1408007

SCHEMBL1408007

CON(C)C(=O)c1cn2c(-c3ccc(Cl)cc3Cl)c(CN(C(=O)O)C(C)(C)C)c(C)nc2n1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.59
DPP8 Q6V1X1 20/20 0.59
DPP9 Q86TI2 19/20 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
SCHEMBL1408021 0.92 DPP4 (0.62) DPP4DPP8DPP9
SCHEMBL1408438 0.88 DPP4 (0.59) DPP4DPP8DPP9
SCHEMBL1408010 0.87 DPP4 (0.59) DPP4DPP8DPP9
SCHEMBL1407424 0.86 DPP4 (0.57) DPP4DPP8DPP9
SCHEMBL8256115 0.85 DPP4 (0.77) DPP4DPP8DPP9
SCHEMBL4494804 0.85 DPP4 (0.60) DPP4DPP8DPP9
SCHEMBL1408142 0.83 DPP4 (0.51) DPP4DPP8DPP9
SCHEMBL1408043 0.82 DPP4 (0.50) DPP4DPP8DPP9
SCHEMBL4494806 0.82 DPP4 (0.54) DPP4DPP8DPP9
SCHEMBL1408338 0.81 DPP4 (0.49) DPP4DPP8DPP9

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
EP-1836206-B1 AZOLOPYRIMIDINE-BASED INHIBITORS OF DIPEPTIDYL PEPTIDASE IV AND METHODS BRISTOL MYERS SQUIBB CO (US) 2011-03-09 EP disclosed