SCHEMBL5228430

SCHEMBL5228430

N#C[C@@H]1CCCN1C(=O)C[C@H](N)Cc1ccccc1F

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.73
DPP8 Q6V1X1 7/20 0.73
DPP9 Q86TI2 5/20 0.73
FAP Q12884 4/20 0.73
DPP7 Q9UHL4 2/20 0.59

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
SCHEMBL6693335 0.85 DPP4 (0.65) DPP4DPP8DPP9FAPDPP7
Hydrochloric Acid SCHEMBL14973464 0.85 DPP4 (0.69) DPP4DPP8DPP9FAPDPP7
SCHEMBL14421643 0.83 DPP4 (0.71) DPP4DPP8DPP9DPP7
SCHEMBL14535255 0.82 DPP4 (0.77) DPP4DPP8DPP9DPP7
SCHEMBL14535419 0.82 DPP4 (0.64) DPP4DPP8DPP9DPP7
SCHEMBL14421644 0.82 DPP4 (0.74) DPP4DPP8DPP9DPP7
SCHEMBL6685925 0.81 DPP4 (0.52) DPP4DPP8DPP9FAPDPP7
SCHEMBL6692186 0.80 DPP4 (0.62) DPP4DPP8DPP9FAPDPP7
SCHEMBL6686205 0.80 DPP4 (0.62) DPP4DPP8DPP9FAPDPP7
SCHEMBL8377973 0.80 DPP4 (0.94) DPP4DPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1406872-B1 DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OF DIABETES MERCK & CO INC (US) 2007-12-19 EP disclosed
EP-1406872-B1 DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OF DIABETES MERCK & CO INC (US) 2007-12-19 EP disclosed
US-7098239-B2 Dipeptidyl peptidase inhibitors for the treatment of diabetes MERCK & CO., INC (US) 2006-08-29 US disclosed
US-20040176428-A1 Dipeptidyl peptidase inhibitors for the treatment of diabetes MERCK SHARP & DOHME CORP. 2004-09-09 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-20040176428-A1 Dipeptidyl peptidase inhibitors for the treatment of diabetes DPP4, DPP3, DPP9 DPP4 1/4885DPP8 6/4885DPP9 3/4885

“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.