SCHEMBL5958085

SCHEMBL5958085

CC(C)(C)C(N)C(=O)N1CC=CC1C#N

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.52
DPP8 Q6V1X1 5/20 0.52
DPP9 Q86TI2 5/20 0.52
FAP Q12884 3/20 0.40
DPP7 Q9UHL4 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
SCHEMBL464954 1.00 DPP4 (0.52) DPP4DPP8DPP9FAPDPP7
SCHEMBL464955 1.00 DPP4 (0.52) DPP4DPP8DPP9FAPDPP7
SCHEMBL7178931 0.89 DPP4 (0.41) DPP4DPP8DPP9FAPDPP7
SCHEMBL7178928 0.89 DPP4 (0.41) DPP4DPP8DPP9FAPDPP7
SCHEMBL7178937 0.86 DPP4 (0.39) DPP4DPP8DPP9FAPDPP7
SCHEMBL7257702 0.85 DPP4 (0.48) DPP4DPP8DPP9FAP
SCHEMBL6172387 0.85 DPP4 (0.48) DPP4DPP8DPP9FAP
SCHEMBL6172382 0.85 DPP4 (0.48) DPP4DPP8DPP9FAP
SCHEMBL7177403 0.84 DPP4 (0.51) DPP4DPP8DPP9FAPDPP7
SCHEMBL6489621 0.84 DPP4 (0.51) DPP4DPP8DPP9FAPDPP7

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8980322-B2 Controlled release composition TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-03-17 US disclosed
US-20060177509-A1 Controlled release composition TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-08-10 US disclosed
US-20060039974-A1 Sustained release preparation TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-02-23 US disclosed
EP-1607088-A1 CONTROLLED RELEASE COMPOSITION Takeda Pharmaceutical Company Limited (JP) 2005-12-21 EP disclosed
EP-1537880-A1 SUSTAINED RELEASE PREPARATION Takeda Pharmaceutical Company Limited (JP) 2005-06-08 EP 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 (2 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-20060039974-A1 Sustained release preparation DPP4, DPP7, DPP3 DPP4 1/4885DPP8 5/4885DPP9 4/4885
US-20060177509-A1 Controlled release composition ATP6AP1, NSF, ATP6V1G1 DPP4 2445/4885DPP8 2848/4885DPP9 1361/4885

“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.