SCHEMBL692637

SCHEMBL692637

COC(=O)[C@@H]1C(O)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
EPHX1 P07099 1/20 0.38
HSD17B10 Q99714 1/20 0.38
HPGD P15428 1/20 0.37
PREP P48147 1/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 1/20 0.36
PTPN1 P18031 1/20 0.36

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
SCHEMBL20729579 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL200722 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL26893965 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL91558 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL8304417 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL27043970 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL200978 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL72827 1.00 CHRM2 (0.41) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL13216436 0.91 HSD17B10 (0.45) CHRM2CHRM1CHRM3EPHX1HSD17B10
SCHEMBL2965236 0.91 HSD17B10 (0.45) CHRM2CHRM1CHRM3EPHX1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116063215-A Synthesis method of 4-amino-L-proline 南京安淮创新药物研究院有限公司 2023-05-05 CN claimed
CN-115010638-B Synthesis method of Nemactetvir intermediate 杭州国瑞生物科技有限公司 2024-02-13 CN disclosed
WO-2023216317-A1 METHOD FOR SYNTHESIZING NIRMATRELVIR INTERMEDIATE 杭州国瑞生物科技有限公司 2023-11-16 WO disclosed
CN-116063215-A Synthesis method of 4-amino-L-proline 南京安淮创新药物研究院有限公司 2023-05-05 CN disclosed
CN-116063215-A Synthesis method of 4-amino-L-proline 南京安淮创新药物研究院有限公司 2023-05-05 CN disclosed
CN-115010638-A Synthesis method of nemadevir intermediate 杭州国瑞生物科技有限公司 2022-09-06 CN disclosed
US-20160002159-A1 PERFLUORO-TERT-BUTYL HYDROXYPROLINE ZONDLO NEAL (US) 2016-01-07 US disclosed
EP-2422791-B1 ANTIVIRAL PHOSPHINATE COMPOUNDS GILEAD SCIENCES INC (US) 2014-12-17 EP disclosed
US-8674088-B2 Antiviral phosphinate compounds GILEAD SCIENCES, INC. (US) 2014-03-18 US disclosed
US-8637449-B2 Processes for preparing protease inhibitors of hepatitis C virus MERCK SHARP & DOHME CORP. (US) 2014-01-28 US disclosed
EP-0731696-A4 CYSTEINE PROTEASE INHIBITORS CONTAINING HETEROCYCLIC LEAVING GROUPS PROTOTEK INC (US) 1999-04-21 EP disclosed
US-5849893-A Nucleic acid-binding oligomers possessing C-branching for therapy and diagnostics BAYER AKTIENGESELLSCHAFT (DE) 1998-12-15 US disclosed
US-5663380-A ANTIARTHRITIC AGENTS; TREATMENT OF RHEUMATOID ARTHRITIS PROTOTEK, INC. (US) 1997-09-02 US disclosed
EP-0731696-A1 CYSTEINE PROTEASE INHIBITORS CONTAINING HETEROCYCLIC LEAVING GROUPS PROTOTEK, INC. (US) 1996-09-18 EP disclosed
US-5486623-A Cysteine protease inhibitors containing heterocyclic leaving groups PROTOTEK, INC. (US) 1996-01-23 US disclosed
US-5438054-A Antibacterial agent BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-08-01 US disclosed
WO-1995015749-A1 CYSTEINE PROTEASE INHIBITORS CONTAINING HETEROCYCLIC LEAVING GROUPS PROTOTEK, INC. (US) 1995-06-15 WO disclosed
EP-0646596-A1 Nucleic acid binding oligomers having C-branches for therapy and diagnosis BAYER AG (DE) 1995-04-05 EP disclosed
US-5374720-A A thienamycins bactericides has nontoxic, side effect reduction against the kidney and central nervous system BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-12-20 US disclosed
EP-0449191-A1 2-(Substituted pyrrolidinylthio)carbapenem derivatives Banyu Pharmaceutical Co., Ltd. (JP) 1991-10-02 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-20160002159-A1 PERFLUORO-TERT-BUTYL HYDROXYPROLINE FIBP, HDGF, PLOD3 CHRM2 4268/4885CHRM1 3948/4885CHRM3 3254/4885

“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.