SCHEMBL12809797

SCHEMBL12809797

Bc1nc2nc(C)c(C(=O)OC)c(-c3ccc(Cl)cc3Cl)n2n1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 15/20 0.59
DPP8 Q6V1X1 5/20 0.46
DPP9 Q86TI2 3/20 0.42
ALPL P05186 1/20 0.41
PLA2G2A P14555 2/20 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
SCHEMBL1408411 0.87 DPP4 (0.62) DPP4DPP8DPP9ALPLPLA2G2A
SCHEMBL1407325 0.87 DPP4 (0.59) DPP4DPP8DPP9ALPLPLA2G2A
SCHEMBL1407673 0.81 DPP4 (0.66) DPP4DPP8DPP9ALPL
SCHEMBL21981605 0.77 DPP4 (0.51) DPP4ALPL
SCHEMBL1408214 0.76 DPP4 (0.63) DPP4DPP8DPP9PLA2G2A
SCHEMBL1408016 0.74 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL1407844 0.71 DPP4 (0.75) DPP4DPP8DPP9
SCHEMBL12809829 0.69 DPP4 (0.67) DPP4DPP8DPP9
SCHEMBL28435242 0.68 MAPT (0.52) DPP4DPP8DPP9ALPLPLA2G2A
SCHEMBL2704427 0.67 PLA2G2A (0.44) DPP4DPP8DPP9ALPLPLA2G2A

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