SCHEMBL5304451

SCHEMBL5304451

N#Cc1ccccc1Cc1nc(N2CCC[C@@H](N)C2)[nH]c(=O)c1F

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 20/20 0.52
CYP3A4 P08684 3/20 0.51

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
SCHEMBL6508227 0.90 DPP4 (0.54) DPP4CYP3A4
SCHEMBL5034640 0.89 DPP4 (0.52) DPP4CYP3A4
SCHEMBL3586029 0.85 DPP4 (0.56) DPP4CYP3A4
SCHEMBL3586023 0.84 DPP4 (0.47) DPP4CYP3A4
SCHEMBL6426896 0.84 DPP4 (0.55) DPP4CYP3A4
SCHEMBL6507784 0.81 DPP4 (0.59) DPP4
SCHEMBL6511158 0.80 DPP4 (0.56) DPP4
SCHEMBL3059451 0.76 DPP4 (0.56) DPP4CYP3A4
SCHEMBL13139857 0.76 DPP4 (0.56) DPP4CYP3A4
SCHEMBL3073729 0.73 DPP4 (0.54) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007033265-A1 DIPEPTIDYL PEPTIDASE INHIBITORS FOR TREATING DIABETIS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-22 WO disclosed
WO-2007033265-A1 DIPEPTIDYL PEPTIDASE INHIBITORS FOR TREATING DIABETIS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-22 WO disclosed
US-20070060529-A1 ADMINISTRATION OF DIPEPTIDYL PEPTIDASE INHIBITORS DEVELOPMENT PARTNERS, LLC 2007-03-15 US disclosed
US-20070060529-A1 ADMINISTRATION OF DIPEPTIDYL PEPTIDASE INHIBITORS DEVELOPMENT PARTNERS, LLC 2007-03-15 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-20070060529-A1 ADMINISTRATION OF DIPEPTIDYL PEPTIDASE INHIBITORS DPP7, DPP4, DPP3 DPP4 2/4885CYP3A4 163/4885

“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.