SCHEMBL6481499

SCHEMBL6481499

CC(C)(C)N(C(=O)O)C1(Cc2ccccc2)CC2SCC(C#N)N2C1=O

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.60
PREP P48147 2/20 0.42

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
SCHEMBL6481495 1.00 DPP4 (0.60) DPP4PREP
SCHEMBL6474088 0.83 DPP4 (0.58) DPP4
SCHEMBL6474090 0.83 DPP4 (0.58) DPP4
SCHEMBL12153725 0.76 DPP4 (1.00) DPP4
SCHEMBL13205202 0.76 DPP4 (1.00) DPP4
Hydrochloric Acid SCHEMBL2981808 0.75 DPP4 (1.00) DPP4
SCHEMBL6062183 0.75 DPP4 (0.66) DPP4PREP
SCHEMBL6062180 0.75 DPP4 (0.66) DPP4PREP
SCHEMBL8270982 0.74 DPP4 (0.69) DPP4PREP
SCHEMBL8271516 0.71 DPP4 (1.00) DPP4

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-20050059716-A1 Novel bicyclic cyanoheterocycles, process for their preparation and their use as medicaments AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-03-17 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-20050059716-A1 Novel bicyclic cyanoheterocycles, process for their preparation and their use as medicaments CYP11B2, GOT2, CYP11B1 DPP4 374/4885PREP 1516/4885

“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.