SCHEMBL4526753

SCHEMBL4526753

CC(=O)C(Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 8/20 0.68
CTSK P43235 7/20 0.68
CTSB P07858 2/20 0.68
CTSL P07711 1/20 0.68
ACE P12821 1/20 0.65
ATM Q13315 1/20 0.60
AKT1 P31749 1/20 0.59
KLK5 Q9Y337 1/20 0.57
REN P00797 1/20 0.56
PPARA Q07869 4/20 0.56
PPARG P37231 3/20 0.56
APP P05067 1/20 0.55
PPARD Q03181 2/20 0.54

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
SCHEMBL7311950 1.00 CTSS (0.68) CTSSCTSKCTSBCTSLACE
SCHEMBL27502336 1.00 CTSS (0.68) CTSSCTSKCTSBCTSLACE
SCHEMBL12826336 0.95 CTSS (0.70) CTSSCTSKCTSBCTSLACE
SCHEMBL18235374 0.93 CTSS (0.70) CTSSCTSKCTSBCTSLACE
SCHEMBL4420859 0.90 REN (0.67) CTSSCTSKCTSBCTSLACE
SCHEMBL7618822 0.90 REN (0.67) CTSSCTSKCTSBCTSLACE
SCHEMBL2173588 0.90 REN (0.67) CTSSCTSKCTSBCTSLACE
SCHEMBL66220 0.90 ACE (0.79) CTSSCTSKCTSBCTSLACE
SCHEMBL21473784 0.90 ACE (0.79) CTSSCTSKCTSBCTSLACE
SCHEMBL67020 0.90 ACE (0.79) CTSSCTSKCTSBCTSLACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109942514-B Method for preparing azalazavir sulfate intermediate 淮海工学院 2022-09-09 CN claimed
CN-109942514-B Method for preparing azalazavir sulfate intermediate 淮海工学院 2022-09-09 CN disclosed
WO-2018065611-A1 2-AMINO-N-(ARYLSULFINYL)-ACETAMIDE COMPOUNDS AS INHIBITORS OF BACTERIAL AMINOACYL-TRNA SYNTHETASE Oxford Drug Design Limited (GB) 2018-04-12 WO disclosed
EP-1697308-B1 PHENYLAMIDE AND PYRIDYLAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK SHARP & DOHME (US) 2014-03-19 EP disclosed
US-7550481-B2 Phenylamide and pyridylamide beta-secretase inhibitors for the treatment of Alzheimer's disease MERCK & CO., INC. (US) 2009-06-23 US disclosed
EP-1697308-A4 PHENYLAMIDE AND PYRIDYLAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER S DISEASE MERCK & CO INC (US) 2007-08-22 EP disclosed
US-20070142634-A1 Phenylamide and pyridylamide beta-secretase inhibitors for the treatment of alzheimer's disease MERCK SHARP & DOHME LLC 2007-06-21 US disclosed
EP-1697308-A2 PHENYLAMIDE AND PYRIDYLAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER S DISEASE Merck & Co., Inc. (US) 2006-09-06 EP disclosed
WO-2005065195-A2 PHENYLAMIDE AND PYRIDYLAMIDE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE MERCK & CO., INC. (US) 2005-07-21 WO disclosed
CN-1202096-C 2-aminothiazoline derivatives and their use as no-synthase inhibitors AVENTIS PHARMA SA (FR) 2005-05-18 CN disclosed
CN-1444572-A 2-aminothiazoline derivatives and their use as no-synthase inhibitors AVENTIS PHARMA SA (FR) 2003-09-24 CN disclosed
US-5387671-A Antiinflammatory agents ABBOTT LABORATORIES (US) 1995-02-07 US disclosed
EP-0564533-A4 MODIFIED HEXA- AND HEPTAPEPTIDE ANAPHYLATOXIN RECEPTOR LIGANDS ABBOTT LAB (US) 1994-11-02 EP disclosed
EP-0564533-A1 MODIFIED PENTA- AND HEXAPEPTIDE ANAPHYLATOXIN RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 1993-10-13 EP disclosed
WO-1992012168-A1 MODIFIED HEXA- AND HEPTAPEPTIDE ANAPHYLATOXIN RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 1992-07-23 WO disclosed
US-5095114-A Process for the enantiomer-selective preparation of γ-keto-δ-amino acid derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-03-10 US disclosed
EP-0408881-A2 Process for the enantioselective preparation of gamma-keto-delta-amino-acid derivatives MERCK PATENT GmbH (DE) 1991-01-23 EP disclosed
US-4826815-A HYPOTENSIVE ABBOTT LABORATORIES (US) 1989-05-02 US disclosed
US-4645759-A HYPOTENSIVE AGENTS ABBOTT LABORATORIES (US) 1987-02-24 US disclosed
EP-0172347-A2 Renin inhibiting compounds ABBOTT LABORATORIES (US) 1986-02-26 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 (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-20070142634-A1 Phenylamide and pyridylamide beta-secretase inhibitors for the treatment of alzheimer's disease BACE1, BACE2, APP CTSS 143/4885CTSK 317/4885CTSB 121/4885

“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.