SCHEMBL28245210

SCHEMBL28245210

COC(=O)N1CCC[C@@H]1C#N

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 17/20 0.57
DPP8 Q6V1X1 4/20 0.55
DPP9 Q86TI2 4/20 0.55
PREP P48147 1/20 0.55

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
SCHEMBL1861006 0.84 TSHR (0.42) DPP4DPP8DPP9PREP
SCHEMBL25096009 0.82 TSHR (0.41) DPP4DPP8DPP9PREP
SCHEMBL2896482 0.81 DPP4 (0.56) DPP4DPP8DPP9PREP
SCHEMBL1357066 0.81 DPP4 (0.56) DPP4DPP8DPP9PREP
SCHEMBL240005 0.81 DPP4 (0.56) DPP4DPP8DPP9PREP
SCHEMBL14606538 0.80 DPP4 (0.52) DPP4DPP8DPP9PREP
SCHEMBL4465428 0.79 DPP4 (0.62) DPP4DPP8DPP9PREP
SCHEMBL1239549 0.79 DPP4 (0.62) DPP4DPP8DPP9PREP
SCHEMBL11469779 0.78 DPP4 (0.60) DPP4DPP8DPP9PREP
Hydrochloric Acid SCHEMBL5964647 0.78 DPP4 (0.60) DPP4DPP8DPP9PREP

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
CN-104918615-B The method for treating hepatopathy 扎夫根股份有限公司 2018-10-12 CN disclosed