SCHEMBL5242009

SCHEMBL5242009

Cc1ccc(-c2c(CC(=O)Nc3cccc(S(C)(=O)=O)c3)c(C)nc(CC(C)C)c2CC(C)(C)C)cc1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.81
DPP8 Q6V1X1 3/20 0.40
DPP9 Q86TI2 2/20 0.40

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
SCHEMBL4110716 0.90 DPP4 (0.81) DPP4DPP8DPP9
Hydrochloric Acid SCHEMBL4105350 0.89 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL5242005 0.88 DPP4 (0.74) DPP4DPP8DPP9
SCHEMBL5318496 0.88 DPP4 (0.74) DPP4DPP8DPP9
Hydrochloric Acid SCHEMBL4113422 0.78 DPP4 (0.67) DPP4DPP8DPP9
SCHEMBL4119311 0.78 DPP4 (0.54) DPP4DPP8DPP9
SCHEMBL5453808 0.77 DPP4 (0.65) DPP4DPP8DPP9
SCHEMBL5739714 0.76 DPP4 (0.47) DPP4DPP8DPP9
Hydrochloric Acid SCHEMBL5452548 0.76 DPP4 (1.00) DPP4DPP8DPP9
Hydrochloric Acid SCHEMBL5447360 0.75 DPP4 (0.82) 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 2 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