SCHEMBL330061

SCHEMBL330061

O=C(CNC(=O)OCc1ccccc1)NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
CTSS P25774 1/20 0.55
CTSK P43235 1/20 0.55
ITGB3 P05106 4/20 0.54
ITGA2B P08514 4/20 0.54
TACR1 P25103 2/20 0.53
ALDH1A1 P00352 1/20 0.53
MME P08473 1/20 0.53
ECE1 P42892 1/20 0.53
CTRB1 P17538 2/20 0.52

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
SCHEMBL8976911 1.00 CTSL (0.55) CTSLCTSBCTSSCTSKITGB3
SCHEMBL5486969 1.00 CTSL (0.55) CTSLCTSBCTSSCTSKITGB3
SCHEMBL18224217 0.97 CTSL (0.53) CTSLCTSBCTSSCTSKITGB3
SCHEMBL16485550 0.97 CTSL (0.53) CTSLCTSBCTSSCTSKITGB3
SCHEMBL11239042 0.97 CTSL (0.53) CTSLCTSBCTSSCTSKITGB3
SCHEMBL13588070 0.95 MME (0.56) CTSLCTSBCTSSCTSKITGB3
SCHEMBL19065177 0.95 MME (0.56) CTSLCTSBCTSSCTSKITGB3
SCHEMBL27829774 0.95 CTSL (0.57) CTSLCTSBCTSSCTSKTACR1
SCHEMBL8583909 0.94 CTSL (0.53) CTSLCTSBCTSSCTSKITGB3
SCHEMBL8583904 0.93 CTSL (0.49) CTSLCTSBCTSSCTSKITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527418-B Preparation method of ADC linker 成都普康唯新生物科技有限公司 2022-05-03 CN disclosed
CN-113527418-A Preparation method of ADC linker 成都普赛唯新生物科技有限公司 2021-10-22 CN disclosed
US-20190276389-A1 SYNTHESIS OF ARYL CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY 2019-09-12 US disclosed
US-20190276389-A1 SYNTHESIS OF ARYL CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY 2019-09-12 US disclosed
EP-3390352-A1 SYNTHESIS OF CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS The Procter and Gamble Company (US) 2018-10-24 EP disclosed
WO-2017106279-A1 SYNTHESIS OF CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS THE PROCTER & GAMBLE COMPANY (US) 2017-06-22 WO disclosed
US-8318798-B2 Therapeutic agent for neurodegenerative disease NATIONAL UNIVERSITY CORPORATION HOKKALDO UNIVERSITY (JP) 2012-11-27 US disclosed
EP-2407167-A2 Therapeutic agent for neurodegenerative disease National University Corporation Hokkaido University (JP) 2012-01-18 EP disclosed
US-20090233872-A1 Therapeutic Agent for Neurodegenerative Disease NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2009-09-17 US disclosed
EP-1974732-A1 THERAPEUTIC AGENT FOR NEURODEGENERATIVE DISEASE National University Corporation Hokkaido University (JP) 2008-10-01 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
US-4719312-A FLUOROALKYLAMINES MERCK & CO., INC. (US) 1988-01-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed
US-4459225-A ANALGESICS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-10 US disclosed
EP-0024664-B1 PEPTIDE AMIDES AND PROCESS FOR THEIR PREPARATION HOECHST AKTIENGESELLSCHAFT (DE) 1983-02-16 EP disclosed
US-4350628-A OXIDATIVE DEHYDROGENATION WITH A BENZOQUINONE RESEARCH CORPORATION (US) 1982-09-21 US disclosed
US-4283328-A TREATING AN N-BLOCKED AMINO ACID RESIDUE WITH A TETRAMETHYL GUANIDINIUM SALT OF A PEPTIDE CHAIN RESEARCH CORPORATION (US) 1981-08-11 US disclosed
US-4261884-A DESIRABLE BIOLOGICAL PROPERTIES AND STABILITY TO ENZYME CLEAVAGE RESEARCH CORPORATION (US) 1981-04-14 US disclosed
EP-0024664-A1 Peptide amides and process for their preparation HOECHST AKTIENGESELLSCHAFT (DE) 1981-03-11 EP disclosed
EP-0010830-A2 Dehydropeptides Research Corporation (US) 1980-05-14 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-20190276389-A1 SYNTHESIS OF ARYL CYCLOHEXANE ESTER DERIVATIVES USEFUL AS SENSATES IN CONSUMER PRODUCTS CUTA, TAS2R8, TRPA1 CTSL 3705/4885CTSB 3333/4885CTSS 1037/4885
US-20090233872-A1 Therapeutic Agent for Neurodegenerative Disease PARK7, HSPD1, FASTKD1 CTSL 2308/4885CTSB 1760/4885CTSS 980/4885

“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.