SCHEMBL5077374

SCHEMBL5077374

N#Cc1cccnc1NCCNCC(=O)N1CCC[C@H]1C#N

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.75
DPP7 Q9UHL4 3/20 0.64
DPP8 Q6V1X1 3/20 0.64
PREP P48147 1/20 0.53

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
SCHEMBL6702155 0.88 DPP4 (0.75) DPP4DPP7DPP8PREP
Oxalic Acid SCHEMBL6696017 0.86 DPP4 (0.66) DPP4DPP7DPP8PREP
SCHEMBL6703266 0.86 DPP4 (0.56) DPP4DPP7DPP8PREP
SCHEMBL6703269 0.86 DPP4 (0.56) DPP4DPP7DPP8PREP
SCHEMBL6595949 0.86 DPP4 (1.00) DPP4DPP7DPP8
SCHEMBL665511 0.85 DPP4 (0.68) DPP4DPP7DPP8PREP
SCHEMBL6704573 0.85 DPP4 (0.55) DPP4DPP7DPP8PREP
SCHEMBL6596978 0.84 DPP4 (1.00) DPP4DPP7DPP8
SCHEMBL4966643 0.84 DPP4 (1.00) DPP4DPP7DPP8
SCHEMBL1614514 0.84 DPP4 (1.00) DPP4DPP7DPP8

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-20080300293-A1 COMBINATION OF AN DPP-IV INHIBITOR AND A PPAR-ALPHA COMPOUND WANG PEI-RAN 2008-12-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080300293-A1 COMBINATION OF AN DPP-IV INHIBITOR AND A PPAR-ALPHA COMPOUND PPARG, DPP4, FABP4 DPP4 2/4885DPP7 18/4885DPP8 17/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.