SCHEMBL13822111

SCHEMBL13822111

CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC=O)C(C)C)C(=O)c1nnc(C(C)(C)C)o1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 19/20 0.51
DPP4 P27487 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP7 Q9UHL4 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
SCHEMBL7005072 0.89 ELANE (0.53) ELANE
SCHEMBL13299879 0.84 ELANE (0.52) ELANE
SCHEMBL13822216 0.82 ELANE (0.55) ELANE
SCHEMBL13822260 0.78 ELANE (0.44) ELANEDPP4DPP8DPP7
SCHEMBL7007704 0.78 ELANE (0.55) ELANE
SCHEMBL13814746 0.77 ELANE (0.50) ELANE
SCHEMBL13299881 0.75 ELANE (0.46) ELANEDPP4DPP8DPP7
SCHEMBL13299870 0.75 ELANE (0.47) ELANE
SCHEMBL13299882 0.75 ELANE (0.47) ELANE
SCHEMBL13299852 0.74 ELANE (0.43) ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156509-A1 Tri-peptide Inhibitors of Serine Elastases ACCUTHERA, INC. (US) 2009-06-18 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-20090156509-A1 Tri-peptide Inhibitors of Serine Elastases SCTR, CTRC, SERPINB1 ELANE 4/4885DPP4 304/4885DPP8 438/4885

“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.