SCHEMBL953572

SCHEMBL953572

CC(C)(C)OC(=O)[C@@](N)(C(=O)O)C(C)(C)O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.40
ALDH1A1 P00352 1/20 0.36
TSHR P16473 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
SCHEMBL2141984 0.84 DGAT1 (0.41) DGAT1ALDH1A1TSHR
SCHEMBL28873923 0.78 DGAT1 (0.36) DGAT1
SCHEMBL617762 0.77 DGAT1 (0.43) DGAT1ALDH1A1TSHR
SCHEMBL18614220 0.76 DGAT1 (0.35) DGAT1
SCHEMBL18614279 0.76 DGAT1 (0.35) DGAT1
SCHEMBL1486198 0.75 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL28535462 0.75 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL27721975 0.75 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL27482953 0.75 DGAT1 (0.44) DGAT1ALDH1A1TSHR
SCHEMBL27859821 0.75 DGAT1 (0.44) DGAT1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4608822-A1 NOVEL SUBSTITUTED PYRAZINE-CARBOXAMIDE DERIVATIVES Boehringer Ingelheim International GmbH (DE) 2025-09-03 EP disclosed
CN-120077036-A Novel substituted pioglitazone oxazine carboxamide derivatives 勃林格殷格翰国际有限公司 2025-05-30 CN disclosed
WO-2024089227-A1 NOVEL SUBSTITUTED PYRAZINE-CARBOXAMIDE DERIVATIVES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-05-02 WO disclosed
CN-117186134-A Arginase inhibitors and methods of use thereof 阿斯利康(瑞典)有限公司 2023-12-08 CN disclosed
CN-117180290-A Arginase inhibitors and methods of use thereof 阿斯利康(瑞典)有限公司 2023-12-08 CN disclosed
CN-111712302-B Arginase inhibitors and methods of use thereof 阿斯利康(瑞典)有限公司 2023-09-19 CN disclosed
WO-2022178215-A1 AMINO AMIDE TETRAHYDRO IMIDAZO PYRIDINES AS JAK INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-08-25 WO disclosed
CN-111712302-A Arginase inhibitors and methods of use thereof 阿斯利康(瑞典)有限公司 2020-09-25 CN disclosed
CN-109020961-A Antiviral compound 吉利德制药有限责任公司 2018-12-18 CN disclosed
CN-104211689-B Antiviral compounds 吉利德制药有限责任公司 2017-01-18 CN disclosed
CN-1974596-B Hepatitis c virus inhibitors BRISTOL MYERS SQUIBB CO 2010-07-28 CN disclosed
US-7728148-B2 Acyclic oximyl hepatitis C protease inhibitors ENANTA PHARMACEUTICALS, INC. (US) 2010-06-01 US disclosed
WO-2009080226-A2 HETEROCYCLIC PYRAZOLE-CARBOXAMIDES AS P2Y12 ANTAGONISTS SANOFIS-AVENTIS (FR) 2009-07-02 WO disclosed
US-20080187516-A1 ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2008-08-07 US disclosed
US-20080125444-A1 ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. 2008-05-29 US disclosed
WO-2007146695-A1 ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2007-12-21 WO disclosed
CN-101024671-A Hepatitis C virus inhibitors BRISTOL MYERS SQUIBB CO (US) 2007-08-29 CN disclosed
CN-1974596-A Hepatitis C virus inhibitors BRISTOL MYERS SQUIBB CO (US) 2007-06-06 CN disclosed
CN-1299677-C Hepatitis C virus inhibitors BRISTOL MYERS SQUIBB CO (US) 2007-02-14 CN disclosed
CN-1668297-A Hepatitis C virus inhibitors BRISTOL MYERS SQUIBB CO (US) 2005-09-14 CN 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-20080125444-A1 ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS CPN1, HPN, HCCS DGAT1 2583/4885ALDH1A1 764/4885TSHR 4619/4885
US-20080187516-A1 ACYCLIC OXIMYL HEPATITIS C PROTEASE INHIBITORS CPN1, HPN, HCCS DGAT1 2583/4885ALDH1A1 764/4885TSHR 4619/4885

“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.