SCHEMBL7316962

SCHEMBL7316962

COC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 13/20 0.51
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
CTSK P43235 1/20 0.50
KLK5 Q9Y337 1/20 0.50
ELANE P08246 1/20 0.50
PEPD P12955 2/20 0.46
XPNPEP1 Q9NQW7 1/20 0.46

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
SCHEMBL8352620 1.00 CMA1 (0.51) CMA1CTSLCTSBCTSKKLK5
SCHEMBL8168154 1.00 CMA1 (0.51) CMA1CTSLCTSBCTSKKLK5
SCHEMBL12598149 0.90 ELANE (0.48) CMA1CTSLCTSBCTSKELANE
SCHEMBL1985159 0.90 ELANE (0.48) CMA1CTSLCTSBCTSKELANE
SCHEMBL28581548 0.90 KLK5 (0.48) CMA1CTSLCTSBCTSKKLK5
SCHEMBL28581545 0.90 KLK5 (0.48) CMA1CTSLCTSBCTSKKLK5
SCHEMBL2162326 0.89 CMA1 (0.61) CMA1CTSLCTSBCTSKELANE
SCHEMBL13258959 0.89 CMA1 (0.51) CMA1CTSLCTSBCTSKELANE
SCHEMBL8168155 0.89 CMA1 (0.61) CMA1CTSLCTSBCTSKELANE
SCHEMBL4445986 0.89 CMA1 (0.61) CMA1CTSLCTSBCTSKELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115210244-B Elastase inhibitor prodrug and application thereof 苏州爱科百发生物医药技术有限公司 2024-11-15 CN disclosed
CN-118772216-A 5-Fluorouracil nucleoside phosphoramidate compound and application thereof 北京深蓝泰医药科技有限公司 2024-10-15 CN disclosed
CN-115210244-A Prodrug of elastase inhibitor and application thereof 苏州爱科百发生物医药技术有限公司 2022-10-18 CN disclosed
CN-113372368-B Prodrug of elastase inhibitor and application thereof 苏州爱科百发生物医药技术有限公司 2022-04-12 CN disclosed
CN-113372368-A Prodrug of elastase inhibitor and application thereof 苏州爱科百发生物医药技术有限公司 2021-09-10 CN disclosed
US-10400263-B2 Tripeptide rhodamine compound KINGSTON UNIVERSITY HIGHER EDUCATION CORPORATION (GB) 2019-09-03 US disclosed
EP-2875040-B1 RHODAMINE BASED FLUORESCENT PROBE FOR COAGULASE ACTIVITY AND DETECTION OF COAGULASE PRODUCING BACTERIAL STRAINS KINGSTON UNIV HIGHER EDUCATION CORP (GB) 2017-10-18 EP disclosed
US-20150240283-A1 Compound Kingston Universty Higher Education Corporation (GB) 2015-08-27 US disclosed
US-20150240283-A1 Compound Kingston Universty Higher Education Corporation (GB) 2015-08-27 US disclosed
WO-2008095058-A1 HCV PROTEASE INHIBITORS TAIGEN BIOTECHNOLOGY CO. LTD. (TW) 2008-08-07 WO disclosed
US-4691007-A HUMAN LEUKOCYTE ELASTASE INHIBITORS ICI AMERICAS INC. (US) 1987-09-01 US disclosed
US-4596789-A Pharmaceuticals ICI AMERICAS INC. (US) 1986-06-24 US disclosed
EP-0124317-A2 Proline derivatives ICI AMERICAS INC. (US) 1984-11-07 EP 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 (2 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-10400263-B2 Tripeptide rhodamine compound RNPEP, PEPD, DNPEP CMA1 409/4885CTSL 13/4885CTSB 62/4885
US-20150240283-A1 Compound RPIA, STS, CLPP CMA1 247/4885CTSL 62/4885CTSB 68/4885

“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.