SCHEMBL30866

SCHEMBL30866

CC(=CC(Cc1ccc(-c2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 11/20 0.59
CTSK P43235 9/20 0.59
CTSB P07858 3/20 0.51
CTSL P07711 1/20 0.51
PTPN1 P18031 1/20 0.51
ATM Q13315 1/20 0.50
BCL2 P10415 1/20 0.50
PPARA Q07869 3/20 0.47
APP P05067 1/20 0.47
ACE P12821 2/20 0.47
PPARG P37231 2/20 0.46
MME P08473 1/20 0.44
ACE2 Q9BYF1 1/20 0.44

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
SCHEMBL28572952 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL45753 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL29373190 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL30867 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL30865 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL18765 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL13566632 1.00 CTSS (0.59) CTSSCTSKCTSBCTSLPTPN1
SCHEMBL15415630 0.93 ATM (0.57) CTSSCTSKCTSBCTSLATM
SCHEMBL2507124 0.93 ATM (0.57) CTSSCTSKCTSBCTSLATM
SCHEMBL15415629 0.93 ATM (0.57) CTSSCTSKCTSBCTSLATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118516422-A Method for synthesizing Sha Kuba koji intermediate by biocatalysis 江苏海洋大学 2024-08-20 CN claimed
CN-118291560-A Synthesis method of sabatier intermediate (2R, 4S) -5- ([ 1,1' -biphenyl ] -4-yl) -4- ((tert-butoxycarbonyl) amino) -2-methyl ethyl valerate 江苏德源药业股份有限公司 2024-07-05 CN claimed
CN-118109528-A Method for biocatalytically synthesizing Sha Kuba- ([ 1,1' -biphenyl ] -4-yl) -4-amino-2-methyl pentanoic acid serving as Sha Kuba yeast intermediate 江苏海洋大学 2024-05-31 CN claimed
CN-114805135-A Synthetic method of key intermediate of Sacubitril 浙江美诺华药物化学有限公司 2022-07-29 CN claimed
CN-111269148-B Preparation method of Sacubitril intermediate 台州职业技术学院 2022-02-08 CN claimed
CN-111269148-A Preparation method of Sacubitril intermediate 台州职业技术学院 2020-06-12 CN claimed
US-9802887-B2 Process for the preparation of intermediates useful for the manufacture NEP inhibitors NOVARTIS AG (CH) 2017-10-31 US claimed
EP-2609071-B1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE OF NEP INHIBITORS NOVARTIS AG (CH) 2016-09-21 EP claimed
US-20150274650-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS HOOK DAVID (CH) 2015-10-01 US claimed
CN-119846111-A Detection method of triphenylphosphine oxide in sarcandesartan sodium starting material 北京四环制药有限公司 2025-04-18 CN disclosed
CN-119613294-A Preparation method of sabatier starter intermediate 浙江达弗氏医药科技有限公司 2025-03-14 CN disclosed
CN-118516422-A Method for synthesizing Sha Kuba koji intermediate by biocatalysis 江苏海洋大学 2024-08-20 CN disclosed
CN-118516422-A Method for synthesizing Sha Kuba koji intermediate by biocatalysis 江苏海洋大学 2024-08-20 CN disclosed
CN-118291560-A Synthesis method of sabatier intermediate (2R, 4S) -5- ([ 1,1' -biphenyl ] -4-yl) -4- ((tert-butoxycarbonyl) amino) -2-methyl ethyl valerate 江苏德源药业股份有限公司 2024-07-05 CN disclosed
US-20130066101-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS NOVARTIS AG (CH) 2013-03-14 US disclosed
WO-2012025502-A1 NEW PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS NOVARTIS AG (CH) 2012-03-01 WO disclosed
US-20090326066-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO-BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS NOVARTIS AG (CH) 2009-12-31 US disclosed
EP-2066618-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO-BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS Novartis AG (CH) 2009-06-10 EP disclosed
EP-1903027-A1 Process for preparing biaryl substituted 4-amino-butyric acid or derivatives thereof and their use in the production of NEP inhibitors Novartis AG (CH) 2008-03-26 EP disclosed
WO-2008031567-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO-BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS NOVARTIS AG (CH) 2008-03-20 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-20130066101-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS MME, REN, BCAT2 CTSS 1512/4885CTSK 3062/4885CTSB 601/4885
US-20090326066-A1 PROCESS FOR PREPARING BIARYL SUBSTITUTED 4-AMINO-BUTYRIC ACID OR DERIVATIVES THEREOF AND THEIR USE IN THE PRODUCTION OF NEP INHIBITORS MME, REN, BCAT2 CTSS 1291/4885CTSK 2982/4885CTSB 521/4885
US-20150274650-A1 PROCESS FOR THE PREPARATION OF INTERMEDIATES USEFUL FOR THE MANUFACTURE NEP INHIBITORS MME, DNPEP, REN CTSS 539/4885CTSK 1034/4885CTSB 399/4885

“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.