SCHEMBL724023

SCHEMBL724023

CC(C)C[C@@H]([C]=O)N(C(=O)OCc1ccccc1)C(=O)[C@@H](N)CC(C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.44
CTSS P25774 5/20 0.44
CTSL P07711 4/20 0.44
CTSB P07858 4/20 0.44
ANPEP P15144 1/20 0.40
RNPEP Q9H4A4 1/20 0.40
DNPEP Q9ULA0 1/20 0.40
ALDH1A1 P00352 2/20 0.38
LARS1 Q9P2J5 1/20 0.38
SLC15A1 P46059 1/20 0.37

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
SCHEMBL7606122 0.93 CTSB (0.43) CTSKCTSSCTSLCTSBANPEP
SCHEMBL7639995 0.87 CTSK (0.43) CTSKCTSSCTSLCTSBSLC15A1
SCHEMBL7420644 0.82 ANPEP (0.43) CTSKCTSSCTSLCTSBANPEP
SCHEMBL7375434 0.82 CTSK (0.64) CTSKCTSSCTSLCTSB
SCHEMBL1014662 0.81 CTSB (0.44) CTSKCTSSCTSLCTSBANPEP
SCHEMBL27809385 0.81 ANPEP (0.48) CTSKCTSSCTSLCTSBANPEP
SCHEMBL7607048 0.81 ABCB1 (0.41) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL7466824 0.80 CTSK (0.49) CTSKCTSSCTSLCTSBALDH1A1
SCHEMBL27473269 0.80 ANPEP (0.45) CTSKCTSSCTSLCTSBANPEP
SCHEMBL27799677 0.80 ANPEP (0.45) CTSKCTSSCTSLCTSBANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2467144-A1 COMBINATION OF PROTEASOME INHIBITORS AND ANTI-HEPATITIS MEDICATION FOR TREATING HEPATITIS ViroLogik GmbH (DE) 2012-06-27 EP claimed
WO-2011009961-A1 COMBINATION OF PROTEASOME INHIBITORS AND ANTI-HEPATITIS MEDICATION FOR TREATING HEPATITIS VIROLOGIK GMBH (DE) 2011-01-27 WO claimed
EP-2078201-A2 DENGUE DIAGNOSIS AND TREATMENT Agency for Science, Technology and Research (SG) 2009-07-15 EP claimed
WO-2008041953-A2 DENGUE DIAGNOSIS AND TREATMENT AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-04-10 WO claimed
EP-0040435-B1 PEPTIDE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Eisai Co., Ltd. (JP) 1983-07-20 EP claimed
EP-0040435-A1 Peptide derivatives and process for the preparation thereof Eisai Co., Ltd. (JP) 1981-11-25 EP claimed
US-11466252-B2 Expansion and differentiation of inner ear supporting cells and methods of use thereof MASSACHUSETTS EYE AND EAR INFIRMARY (US) 2022-10-11 US disclosed
US-20190010449-A1 Expansion and Differentiation of Inner Ear Supporting Cells and Methods of Use Thereof MASSACHUSETTS EYE AND EAR INFIRMARY 2019-01-10 US disclosed
WO-2015104292-A2 COMPOUNDS FOR USE IN TREATING OR PREVENTING CANCEROUS DISEASES BIOMEDICAL RESEARCH FOUNDATION OF THE ACADEMY OF ATHENS (GR) 2015-07-16 WO disclosed
US-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN AKRON MOLECULES AG (AT) 2014-11-27 US disclosed
US-20130252924-A1 Compounds and Methods for Treating Pain AKRON MOLECULES GMBH (AT) 2013-09-26 US disclosed
EP-2637649-A2 COMPOUNDS AND METHODS FOR TREATING PAIN Akron Molecules GmbH (AT) 2013-09-18 EP disclosed
EP-2608811-A1 ALUMINA NANOPARTICLE BIOCONJUGATES AND METHODS OF STIMULATING AN IMMUNE RESPONSE USING SAID BIOCONJUGATES Providence Health System - Oregon (US) 2013-07-03 EP disclosed
WO-2009067543-A2 TREATMENT OF HISTONE DEACETYLASE MEDIATED DISORDERS THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2009-05-28 WO disclosed
EP-1382691-B1 Method for the isolation of the 20S proteasome, and methods for the identification of 20S and 26S proteasome inhibitors BAYER CROPSCIENCE AG (DE) 2006-10-18 EP disclosed
EP-1492545-A1 AGENTS FOR TREATING I FLAVIVIRIDAE /I INFECTIONS VIROMICS GMBH (DE) 2005-01-05 EP disclosed
EP-1382691-A2 Method for the isolation of the 20S proteasome, and methods for the identification of 20S and 26S proteasome inhibitors Bayer CropScience AG (DE) 2004-01-21 EP disclosed
WO-2003084551-A1 AGENTS FOR TREATING FLAVIVIRIDAE INFECTIONS VIROMICS GMBH (DE) 2003-10-16 WO disclosed
EP-0040435-B1 PEPTIDE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Eisai Co., Ltd. (JP) 1983-07-20 EP disclosed
EP-0040435-A1 Peptide derivatives and process for the preparation thereof Eisai Co., Ltd. (JP) 1981-11-25 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-20140349969-A1 COMPOUNDS AND METHODS FOR TREATING PAIN TRPV1, ACHE, OPRL1 CTSK 357/4885CTSS 661/4885CTSL 1583/4885
US-20130252924-A1 Compounds and Methods for Treating Pain TRPV1, ACHE, OPRL1 CTSK 357/4885CTSS 661/4885CTSL 1583/4885

“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.