SCHEMBL5452657

SCHEMBL5452657

Cc1ccc(-c2c(CC(=O)N3CCOCC3)c(C)nc(CC(C)C)c2CN)cc1

nearest known ligand 0.70

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.70
DPP9 Q86TI2 2/20 0.64
DPP8 Q6V1X1 2/20 0.58

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
Hydrochloric Acid SCHEMBL5443095 0.99 DPP4 (0.71) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5445509 0.90 DPP4 (0.72) DPP4DPP9DPP8
SCHEMBL5740976 0.89 DPP4 (0.56) DPP4DPP9DPP8
SCHEMBL5451900 0.88 DPP4 (0.55) DPP4DPP9DPP8
SCHEMBL5740971 0.87 DPP4 (0.56) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5453632 0.85 DPP4 (0.77) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5445009 0.82 DPP4 (0.78) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5449113 0.82 DPP4 (0.56) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5449842 0.80 DPP4 (1.00) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5461745 0.80 DPP4 (0.83) DPP4DPP9DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070037807-A1 Pyridine compounds as inhibitors of dipeptidyl peptidase IV TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 US claimed
US-20070259927-A1 Remedy for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED 2007-11-08 US disclosed
EP-1782832-A1 REMEDY FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2007-05-09 EP disclosed
US-20070037807-A1 Pyridine compounds as inhibitors of dipeptidyl peptidase IV TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 US disclosed
EP-1678138-A1 PYRIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV Takeda Pharmaceutical Company Limited (JP) 2006-07-12 EP disclosed
WO-2005042488-A1 PYRIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-05-12 WO 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-20070259927-A1 Remedy for Diabetes IAPP, DPP4, PNLIP DPP4 2/4885DPP9 10/4885DPP8 8/4885
US-20070037807-A1 Pyridine compounds as inhibitors of dipeptidyl peptidase IV DPP4, DPP3, PEPD DPP4 1/4885DPP9 5/4885DPP8 8/4885

“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.