SCHEMBL5066716

SCHEMBL5066716

CNCC(C)(C)NCC(=O)N1CCCC1C#N

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.79
DPP8 Q6V1X1 1/20 0.76
DPP9 Q86TI2 1/20 0.76
DPP7 Q9UHL4 1/20 0.60

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
SCHEMBL5068334 1.00 DPP4 (0.79) DPP4DPP8DPP9DPP7
SCHEMBL5066712 0.87 DPP4 (0.75) DPP4DPP8DPP9
SCHEMBL5066742 0.87 DPP4 (0.75) DPP4DPP8DPP9DPP7
SCHEMBL5070890 0.87 DPP4 (0.75) DPP4DPP8DPP9
SCHEMBL17460442 0.87 DPP4 (0.79) DPP4DPP8DPP9DPP7
Hydrochloric Acid SCHEMBL6595556 0.87 DPP4 (0.79) DPP4DPP8DPP9
SCHEMBL8274117 0.87 DPP4 (0.79) DPP4DPP8DPP9DPP7
SCHEMBL6255154 0.86 DPP4 (1.00) DPP4DPP8DPP9
SCHEMBL7337712 0.86 DPP4 (0.73) DPP4DPP8DPP9
Hydrochloric Acid SCHEMBL17460444 0.86 DPP4 (0.73) DPP4DPP8DPP9DPP7

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
US-7345180-B2 Compound inhibiting dipeptidyl peptidase IV SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2008-03-18 US disclosed