SCHEMBL594571

SCHEMBL594571

CC(C)(C)OC(=O)[C@@H](N)Cc1ccc(O)cc1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.57
TAAR1 Q96RJ0 3/20 0.49
SLC6A2 P23975 1/20 0.49
ESR1 P03372 3/20 0.46
ESR2 Q92731 2/20 0.46
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46
HDAC8 Q9BY41 2/20 0.44
LY96 Q9Y6Y9 1/20 0.44
BLM P54132 1/20 0.42
ERAP2 Q6P179 1/20 0.42
LNPEP Q9UIQ6 1/20 0.42

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
SCHEMBL7464405 1.00 SLC7A5 (0.57) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL630703 1.00 SLC7A5 (0.57) SLC7A5TAAR1SLC6A2ESR1ESR2
Hydrochloric Acid SCHEMBL27704336 0.98 SLC7A5 (0.56) SLC7A5TAAR1SLC6A2ESR1ESR2
Hydrochloric Acid SCHEMBL4422991 0.98 SLC7A5 (0.56) SLC7A5TAAR1SLC6A2ESR1ESR2
Hydrochloric Acid SCHEMBL7687022 0.98 SLC7A5 (0.56) SLC7A5TAAR1SLC6A2ESR1ESR2
SCHEMBL7395431 0.88 ACACB (0.44) SLC7A5ESR1ESR2CTSSCTSK
SCHEMBL6666822 0.87 SLC7A5 (0.45) SLC7A5
SCHEMBL3203564 0.87 SLC7A5 (0.45) SLC7A5
SCHEMBL17978113 0.87 SLC7A5 (0.45) SLC7A5
SCHEMBL17978114 0.87 SLC7A5 (0.45) SLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122079826-A HDAC inhibitor based on tyrosine skeleton, and synthesis method and application thereof 2026-05-26 CN claimed
US-12582742-B2 Packaging solutions BAUSCH + LOMB IRELAND LIMITED (IE) 2026-03-24 US claimed
US-20260027227-A1 NOVEL THIOL REDUCTANT, METHOD AND USE THEREOF SUZHOU BIOREINNO BIOTECHNOLOGY LTD COMPANY (CN) 2026-01-29 US claimed
US-20250326775-A1 A NOVEL THIOL REDUCTANT, PREPARATION METHOD AND USE THEREOF SUZHOU BIOREINNO BIOTECHNOLOGY LTD COMPANY (CN) 2025-10-23 US claimed
EP-4577552-A1 A NOVEL THIOL REDUCTANT, METHOD AND USE THEREOF SUZHOU BIOREINNO BIOTECHNOLOGY LIMITED COMPANY (CN) 2025-07-02 EP claimed
EP-4536670-A1 A NOVEL THIOL REDUCTANT, PREPARATION METHOD AND USE THEREOF SUZHOU BIOREINNO BIOTECHNOLOGY LIMITED COMPANY (CN) 2025-04-16 EP claimed
CN-119470406-A Phthalic dicarboxaldehyde disinfectant concentration detection test paper and preparation method thereof 山东新华莎罗雅生物技术有限公司 2025-02-18 CN claimed
CN-119365471-A Novel thiol reducing agents, methods and uses thereof 苏州佰睿壹生物技术有限公司 2025-01-24 CN claimed
CN-119241385-A Beta-acyloxy enamide derivative and preparation method and application thereof 江西师范大学 2025-01-03 CN claimed
WO-2024041541-A1 A NOVEL THIOL REDUCTANT, METHOD AND USE THEREOF SUZHOU BIOREINNO BIOTECHNOLOGY LIMITED COMPANY (CN) 2024-02-29 WO claimed
CN-102320950-A Method for synthesizing acetic acid through carbonylation SHANGHAI HUAYI GROUP CO 2012-01-18 CN claimed
CN-101658800-B Catalyst system for use in preparation of acetic acid and acetic anhydride or synchronous preparation of acetic acid and acetic anhydride and preparation method thereof SHANGHAI COKING & CHEM CORP 2011-11-02 CN claimed
CN-101927201-A Method for removing impurities from solution of acetic acid and/or acetic anhydride hydroformylation catalyst SHANGHAI COKING & CHEM CORP 2010-12-29 CN claimed
CN-101658800-A Catalyst system for use in preparation of acetic acid and acetic anhydride or synchronous preparation of acetic acid and acetic anhydride and preparation method thereof SHANGHAI COKING & CHEMICAL COR 2010-03-03 CN claimed
CN-101659607-A Method for preparing acetic acid and acetic anhydride respectively or synchronously SHANGHAI COKING & CHEMICAL COR 2010-03-03 CN claimed
EP-1051195-A4 IDENTIFICATION OF AGENTS THAT PROTECT AGAINST INFLAMMATORY INJURY TO NEURONS BAYLOR COLLEGE MEDICINE (US) 2004-06-09 EP claimed
EP-1051195-A1 IDENTIFICATION OF AGENTS THAT PROTECT AGAINST INFLAMMATORY INJURY TO NEURONS BAYLOR COLLEGE OF MEDICINE (US) 2000-11-15 EP claimed
CN-1265672-A Sulphonylated dipeptide Compounds capable of inhibiting leukocyte adhesion mediated by VLA-4 ELAND PHARMACEUTICALS CO (US) 2000-09-06 CN claimed
US-6043283-A ADMINISTERING TYRAMINE COMPOUND TO PATIENT TO INHIBIT INJURY, DESTRUCTION OR DEATH OF NEURONS BAYLOR COLLEGE OF MEDICINE (US) 2000-03-28 US claimed
WO-1998011923-A1 IDENTIFICATION OF AGENTS THAT PROTECT AGAINST INFLAMMATORY INJURY TO NEURONS BAYLOR COLLEGE OF MEDICINE (US) 1998-03-26 WO claimed

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-20260027227-A1 NOVEL THIOL REDUCTANT, METHOD AND USE THEREOF CBR1, SCLY, SSB SLC7A5 251/4885TAAR1 1769/4885SLC6A2 3125/4885
US-20250326775-A1 A NOVEL THIOL REDUCTANT, PREPARATION METHOD AND USE THEREOF TMT1A, TST, PRDX3 SLC7A5 2322/4885TAAR1 3472/4885SLC6A2 3672/4885
US-12582742-B2 Packaging solutions CD44, DSG1, HPSE SLC7A5 410/4885TAAR1 2737/4885SLC6A2 1713/4885

“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.