SCHEMBL4445986

SCHEMBL4445986

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H]1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 13/20 0.61
ELANE P08246 1/20 0.53
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
CTSK P43235 1/20 0.51
ACE P12821 3/20 0.50
REN P00797 1/20 0.48

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
SCHEMBL2162326 1.00 CMA1 (0.61) CMA1ELANECTSLCTSBCTSK
SCHEMBL6284248 1.00 CMA1 (0.61) CMA1ELANECTSLCTSBCTSK
SCHEMBL8168155 1.00 CMA1 (0.61) CMA1ELANECTSLCTSBCTSK
SCHEMBL17378396 1.00 CMA1 (0.61) CMA1ELANECTSLCTSBCTSK
SCHEMBL6740347 0.92 CMA1 (0.53) CMA1ELANECTSLCTSBCTSK
SCHEMBL29787416 0.91 CMA1 (0.53) CMA1ELANECTSLCTSBCTSK
SCHEMBL13258959 0.90 CMA1 (0.51) CMA1ELANECTSLCTSBCTSK
SCHEMBL28603270 0.89 CMA1 (0.51) CMA1ELANEACEREN
SCHEMBL28603273 0.89 CMA1 (0.51) CMA1ELANEACEREN
SCHEMBL28603275 0.89 CMA1 (0.51) CMA1ELANEACEREN

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 CMA1 18/4885ELANE 4/4885CTSL 82/4885

“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.