SCHEMBL939477

SCHEMBL939477

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

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 10/20 0.50
CTSK P43235 9/20 0.50
CTSL P07711 2/20 0.48
CTSB P07858 2/20 0.48
PPARA Q07869 6/20 0.45
PPARG P37231 5/20 0.45
ACE P12821 1/20 0.44
PPARD Q03181 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL305190 1.00 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL755894 1.00 CTSS (0.50) CTSSCTSKCTSLCTSBPPARA
SCHEMBL7330819 0.91 CTSK (0.44) CTSSCTSKCTSLCTSBPPARA
SCHEMBL15582702 0.87 CTSS (0.48) CTSSCTSKCTSLCTSBCA1
SCHEMBL1688920 0.87 CTSK (0.47) CTSSCTSKCTSLCTSBCA1
SCHEMBL3735030 0.87 CTSK (0.47) CTSSCTSKCTSLCTSBCA1
SCHEMBL12973256 0.87 CTSK (0.47) CTSSCTSKCTSLCTSBCA1
SCHEMBL3733285 0.87 CTSK (0.47) CTSSCTSKCTSLCTSBCA1
SCHEMBL16000767 0.87 CTSK (0.47) CTSSCTSKCTSLCTSBCA1
SCHEMBL16343552 0.86 CTSK (0.46) CTSSCTSKCTSLCTSBPPARA

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 101 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4440563-A1 COMPOSITIONS AND METHODS USING AN AMINO ACID BLEND FOR PROVIDING A HEALTH BENEFIT IN AN ANIMAL Société des Produits Nestlé S.A. (CH) 2024-10-09 EP claimed
EP-4259120-A1 COMPOSITIONS AND METHODS USING AT LEAST ONE GLYCINE OR DERIVATIVE THEREOF AND AT LEAST ONE LARGE NEUTRAL AMINO ACID AND/OR CATIONIC AMINO ACID OR PRECURSOR THEREOF Société des Produits Nestlé S.A. (CH) 2023-10-18 EP claimed
CN-112778162-B Preparation method of chiral beta- (Boc-amino) -5-hexynoic acid 上海海皋科技有限公司 2023-06-16 CN claimed
WO-2023100077-A1 COMPOSITIONS AND METHODS USING AN AMINO ACID BLEND FOR PROVIDING A HEALTH BENEFIT IN AN ANIMAL SOCIETE DES PRODUITS NESTLE SA (CH) 2023-06-08 WO claimed
WO-2022122730-A1 COMPOSITIONS AND METHODS USING AT LEAST ONE GLYCINE OR DERIVATIVE THEREOF AND AT LEAST ONE LARGE NEUTRAL AMINO ACID AND/OR CATIONIC AMINO ACID OR PRECURSOR THEREOF Société des Produits Nestlé S.A. (CH) 2022-06-16 WO claimed
CN-112778162-A Preparation method of chiral beta- (Boc-amino) -5-hexynoic acid 上海海皋科技有限公司 2021-05-11 CN claimed
EP-4615434-A1 COMPOSITIONS AND METHODS USING GLYCINE TO REDUCE BIOLOGICAL AGE OF AN ADULT ANIMAL Société des Produits Nestlé S.A. (CH) 2025-09-17 EP disclosed
EP-4440563-A1 COMPOSITIONS AND METHODS USING AN AMINO ACID BLEND FOR PROVIDING A HEALTH BENEFIT IN AN ANIMAL Société des Produits Nestlé S.A. (CH) 2024-10-09 EP disclosed
EP-4425181-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE Bertis Inc (KR) 2024-09-04 EP disclosed
WO-2024099883-A1 COMPOSITIONS AND METHODS USING GLYCINE TO REDUCE BIOLOGICAL AGE OF AN ADULT ANIMAL Société des Produits Nestlé S.A. (CH) 2024-05-16 WO disclosed
US-20240011979-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS INC. (KR) 2024-01-11 US disclosed
EP-4259120-A1 COMPOSITIONS AND METHODS USING AT LEAST ONE GLYCINE OR DERIVATIVE THEREOF AND AT LEAST ONE LARGE NEUTRAL AMINO ACID AND/OR CATIONIC AMINO ACID OR PRECURSOR THEREOF Société des Produits Nestlé S.A. (CH) 2023-10-18 EP disclosed
CN-112778162-B Preparation method of chiral beta- (Boc-amino) -5-hexynoic acid 上海海皋科技有限公司 2023-06-16 CN disclosed
US-7399766-B2 Soluble amide & ester pyrazinoylguanidine sodium channel blockers PARION SCIENCES, INC. (US) 2008-07-15 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
US-20070021439-A1 Methods of reducing risk of infection from pathogens with soluble amide and ester pyrazinoylguanidine sodium channel blockers PARION SCIENCES, INC. 2007-01-25 US disclosed
US-20070021439-A1 Methods of reducing risk of infection from pathogens with soluble amide and ester pyrazinoylguanidine sodium channel blockers PARION SCIENCES, INC. 2007-01-25 US disclosed
US-20060142581-A1 Hetero substitued sodium channel blockers PARION SCIENCES, INC. (US) 2006-06-29 US disclosed
US-20060040954-A1 Soluble amide & ester pyrazinoylguanidine sodium channel blockers PARION SCIENCES, INC. (US) 2006-02-23 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 (4 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-20060142581-A1 Hetero substitued sodium channel blockers SCN2B, CACNA1B, CACNA1G CTSS 4492/4885CTSK 4380/4885CTSL 4544/4885
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 CTSS 1105/4885CTSK 2645/4885CTSL 912/4885
US-20060040954-A1 Soluble amide & ester pyrazinoylguanidine sodium channel blockers SCN2A, CACNA1B, HCN4 CTSS 3583/4885CTSK 3600/4885CTSL 3027/4885
US-20070021439-A1 Methods of reducing risk of infection from pathogens with soluble amide and ester pyrazinoylguanidine sodium channel blockers KCNN2, KCNN1, KCNN3 CTSS 1323/4885CTSK 1945/4885CTSL 468/4885

“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.