SCHEMBL6344320

SCHEMBL6344320

COC(=O)C(CCc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.68
CTSS P25774 5/20 0.68
KLK5 Q9Y337 2/20 0.57
CTSB P07858 2/20 0.54
CTSL P07711 1/20 0.54
PPARA Q07869 4/20 0.53
PPARG P37231 3/20 0.53
ACE P12821 1/20 0.52
ATM Q13315 1/20 0.50
SCN9A Q15858 1/20 0.49
PPARD Q03181 2/20 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
SCHEMBL12560624 1.00 CTSK (0.68) CTSKCTSSKLK5CTSBCTSL
SCHEMBL7032329 1.00 CTSK (0.68) CTSKCTSSKLK5CTSBCTSL
SCHEMBL7300194 0.92 CTSK (0.60) CTSKCTSSKLK5CTSBCTSL
SCHEMBL23734347 0.92 CTSS (0.62) CTSKCTSSKLK5CTSBCTSL
SCHEMBL23176824 0.90 CTSK (0.58) CTSKCTSSKLK5CTSBCTSL
Serine SCHEMBL7732130 0.90 CTSK (0.57) CTSKCTSSKLK5CTSBCTSL
SCHEMBL3881683 0.90 CTSS (0.65) CTSKCTSSKLK5CTSBCTSL
SCHEMBL8062883 0.90 CTSS (0.65) CTSKCTSSKLK5CTSBCTSL
SCHEMBL8696309 0.90 CTSS (0.65) CTSKCTSSKLK5CTSBCTSL
SCHEMBL21883815 0.89 CTSS (0.65) CTSKCTSSKLK5CTSBCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114269431-A Enzyme inhibitors 卡尔维斯塔制药有限公司 2022-04-01 CN disclosed
US-20150266920-A1 MACROCYCLIC KETOAMIDE IMMUNOPROTEASOME INHIBITORS HOFFMANN-LA ROCHE INC. 2015-09-24 US disclosed
EP-2906582-A1 MACROCYCLIC KETOAMIDE IMMUNOPROTEASOME INHIBITORS F. Hoffmann-La Roche AG (CH) 2015-08-19 EP disclosed
CN-104854124-A Macrocyclic ketoamide immunoproteasome inhibitors HOFFMANN LA ROCHE 2015-08-19 CN disclosed
WO-2014056954-A1 MACROCYCLIC KETOAMIDE IMMUNOPROTEASOME INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2014-04-17 WO disclosed
US-6846820-B2 For therapy of diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PFIZER INC. (US) 2005-01-25 US disclosed
US-20040006088-A1 For therapy of diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PFIZER INC. 2004-01-08 US disclosed
US-6649634-B2 Use in treating diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PFIZER, INC. 2003-11-18 US disclosed
US-20020028810-A1 Use in treating diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals HOOVER DENNIS J (US) 2002-03-07 US disclosed
US-6297269-B1 Substituted n-(indole-2-carbonyl-) amides and derivatives as glycogen phosphorylase inhibitors PFIZER INC. 2001-10-02 US disclosed
EP-0832066-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL-) AMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-09-12 EP disclosed
CN-1178517-A Process for reduction of carbonyl compounds KANEKA CORP (JP) 1998-04-08 CN disclosed
EP-0832066-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL-) AMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996039385-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL-) AMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1996-12-12 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 (3 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-20020028810-A1 Use in treating diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PYGL, GPR119, PYGM CTSK 2876/4885CTSS 2125/4885KLK5 3701/4885
US-20040006088-A1 For therapy of diabetes, hyperglycemia, hypercholesterolemia, hypertension, hyperinsulinemias, hyperlipidemia, atherosclerosis and myocardial ischemia in mammals PYGL, GPR119, PYGM CTSK 3164/4885CTSS 2377/4885KLK5 3737/4885
US-20150266920-A1 MACROCYCLIC KETOAMIDE IMMUNOPROTEASOME INHIBITORS PSMB7, PSMC2, PSMB8 CTSK 68/4885CTSS 91/4885KLK5 186/4885

“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.