SCHEMBL5239155

SCHEMBL5239155

Cc1ccc(-c2c(CO)c(C)nc(CC(C)(C)C)c2CN(C(=O)O)C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.56
DPP9 Q86TI2 9/20 0.52
DPP8 Q6V1X1 8/20 0.52
GCGR P47871 1/20 0.34

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
SCHEMBL5242026 0.89 DPP4 (0.59) DPP4DPP9DPP8GCGR
SCHEMBL5241485 0.88 DPP4 (0.53) DPP4DPP9DPP8
SCHEMBL5239400 0.87 DPP4 (0.54) DPP4DPP9DPP8
SCHEMBL5739328 0.82 DPP4 (0.59) DPP4DPP9DPP8GCGR
SCHEMBL4119064 0.82 DPP4 (0.60) DPP4DPP9DPP8GCGR
SCHEMBL5804678 0.81 DPP4 (0.46) DPP4DPP9DPP8
SCHEMBL5822551 0.81 DPP4 (0.46) DPP4DPP9DPP8
SCHEMBL5806839 0.81 DPP4 (0.46) DPP4DPP9DPP8
SCHEMBL5244235 0.80 DPP4 (0.56) DPP4DPP9DPP8GCGR
SCHEMBL5740441 0.78 DPP4 (0.64) DPP4DPP9DPP8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1851202-A1 PYRIDYL ACETIC ACID COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2007-11-07 EP disclosed
WO-2006090915-A1 PYRIDYL ACETIC ACID COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-08-31 WO disclosed
EP-1678138-A1 PYRIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV Takeda Pharmaceutical Company Limited (JP) 2006-07-12 EP disclosed
WO-2005042488-A1 PYRIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-05-12 WO disclosed