SCHEMBL6740347

SCHEMBL6740347

CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC1C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 12/20 0.53
CTSK P43235 2/20 0.50
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
PREP P48147 1/20 0.48
ELANE P08246 2/20 0.46
CTSS P25774 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 1/20 0.43

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
SCHEMBL6284248 0.92 CMA1 (0.61) CMA1CTSKCTSLCTSBELANE
SCHEMBL8168155 0.92 CMA1 (0.61) CMA1CTSKCTSLCTSBELANE
SCHEMBL4445986 0.92 CMA1 (0.61) CMA1CTSKCTSLCTSBELANE
SCHEMBL17378396 0.92 CMA1 (0.61) CMA1CTSKCTSLCTSBELANE
SCHEMBL2162326 0.92 CMA1 (0.61) CMA1CTSKCTSLCTSBELANE
SCHEMBL9546595 0.84 CTSK (0.52) CMA1CTSKCTSLCTSBPREP
SCHEMBL29787416 0.83 CMA1 (0.53) CMA1CTSKCTSLCTSBELANE
SCHEMBL25054017 0.83 ACE (0.43) CMA1CTSKCTSLPREPCTSS
SCHEMBL28576870 0.83 ACE (0.43) CMA1CTSKCTSLPREPCTSS
SCHEMBL28576872 0.83 ACE (0.43) CMA1CTSKCTSLPREPCTSS

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
US-6693072-B2 Elastase inhibitors AVENTIS PHARMACEUTICALS INC. 2004-02-17 US disclosed
EP-0804465-B1 NOVEL ELASTASE INHIBITORS AVENTIS PHARMA INC (US) 2003-08-06 EP disclosed
US-20030096759-A1 Novel elastase inhibitors AVENTISUB II INC. 2003-05-22 US disclosed
WO-1995033763-A1 NOVEL ELASTASE INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1995-12-14 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-20030096759-A1 Novel elastase inhibitors ELANE, SERPINB1, MMP8 CMA1 75/4885CTSK 162/4885CTSL 52/4885

“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.