SCHEMBL5446384

SCHEMBL5446384

Cc1nc(CC(C)(C)C)c(CN)c(-c2ccc(Cl)cc2)c1C(=O)O

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.81
DPP9 Q86TI2 9/20 0.81
DPP8 Q6V1X1 8/20 0.81
FABP3 P05413 1/20 0.44
FABP4 P15090 1/20 0.44

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 SCHEMBL5740718 0.99 DPP4 (0.83) DPP4DPP9DPP8FABP3FABP4
Hydrochloric Acid SCHEMBL5451171 0.99 DPP4 (0.83) DPP4DPP9DPP8FABP3FABP4
SCHEMBL5449899 0.91 DPP4 (0.70) DPP4DPP9DPP8FABP3FABP4
SCHEMBL5450604 0.91 DPP4 (0.98) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5455614 0.89 DPP4 (1.00) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5447311 0.89 DPP4 (0.72) DPP4DPP9DPP8FABP3FABP4
Hydrochloric Acid SCHEMBL5740724 0.88 DPP4 (0.66) DPP4DPP9DPP8
Cadaverine Tartrate SCHEMBL5451901 0.87 DPP4 (0.85) DPP4DPP9DPP8
SCHEMBL5457219 0.87 DPP4 (0.62) DPP4DPP9DPP8
Hydrochloric Acid SCHEMBL5443519 0.86 DPP4 (0.82) DPP4DPP9DPP8FABP3FABP4

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 3 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 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 (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-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.