SCHEMBL16983021

SCHEMBL16983021

CC(C)(COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O)C(O)C(=O)NCCC(=O)NCCSC(=O)CCO

nearest known ligand 0.89

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NAA50 Q9GZZ1 2/20 0.88
▸ CHAT P28329 2/20 0.84
▸ EP300 Q09472 3/20 0.83
▸ KAT5 Q92993 2/20 0.83
▸ AURKA O14965 2/20 0.83
▸ KAT2B Q92831 1/20 0.83
▸ CREBBP Q92793 1/20 0.74
▸ NAA40 Q86UY6 1/20 0.72

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
SCHEMBL60498 1.00 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL18327204 1.00 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
SCHEMBL14878909 1.00 NAA50 (0.88) NAA50CHATEP300KAT5AURKA
Bromide SCHEMBL30997587 0.99 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL18614737 0.97 NAA50 (0.84) NAA50CHATEP300KAT5AURKA
SCHEMBL18925864 0.97 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL19554420 0.97 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL59555 0.97 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL2933622 0.97 NAA50 (0.87) NAA50CHATEP300KAT5AURKA
SCHEMBL28077759 0.97 NAA50 (0.84) NAA50CHATEP300KAT5AURKA

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-111194353-A Poly (3-hydroxypropionate-B-lactate) block copolymer using microorganism 株式会社LG化学 2020-05-22 — — CN claimed
CN-107075536-A The method for producing the methylbutanoic acid of 3 hydroxyl 3 环球生物能源公司 2017-08-18 — — CN claimed
CN-103890186-A Microorganisms and methods for producing acrylates and other products via homoserine PROCTER & GAMBLE 2014-06-25 — — CN claimed
CN-1714146-A Alanine 2, 3-aminomutase CARGILL INC (US) 2005-12-28 — — CN claimed
CN-1556855-A 3-hydroxypropionic acid and other organic compounds 卡吉尔公司 2004-12-22 — — CN claimed
CN-119709450-A Recombinant host cells for malonate production 利戈斯股份有限公司 2025-03-28 — — CN disclosed
CN-114616330-B Recombinant host cells for malonate production 利戈斯股份有限公司 2025-01-03 — — CN disclosed
CN-118086086-A Recombinant host cells for malonate production 利戈斯股份有限公司 2024-05-28 — — CN disclosed
US-20240052332-A1 OLIVETOLIC ACID CYCLASE VARIANTS AND METHODS FOR THEIR USE CREO INGREDIENTS, INC. 2024-02-15 — — US disclosed
CN-116601300-A Bioconversion of ferulic acid to vanillin 巴斯夫欧洲公司 2023-08-15 — — CN disclosed
CN-115916988-A Production of ethanol and one or more by-products in yeast 布拉斯科公司 2023-04-04 — — CN disclosed
US-20220347192-A1 PRENYLTRANSFERASE VARIANTS AND METHODS FOR PRODUCTION OF PRENYLATED AROMATIC COMPOUNDS CREO INGREDIENTS, INC. 2022-11-03 — — US disclosed
CN-101528658-B Method for producing acrylic acid purified by crystallization from hydroxypropionic acid and apparatus therefor STOCKHAUSEN CHEM FAB GMBH 2013-04-03 — — CN disclosed
CN-102625845-A Microorganisms and methods for the synergistic production of isopropanol and primary alcohols, glycols and acids GENOMATICA INC 2012-08-01 — — CN disclosed
CN-102216463-A Microbial ethanol production JOULE BIOTECHNOLOGIES INC 2011-10-12 — — CN disclosed
CN-102015995-A Carbon dioxide fixing engineering microorganism for producing carbon-based target product JOULE UNLTD INC 2011-04-13 — — CN disclosed
CN-101974439-A Microbiological production of 3-hydroxypropionic acid FORSCHUNGSZENTRUM JUELICH GMBH 2011-02-16 — — CN disclosed
CN-101528658-A Method for producing acrylic acid purified by crystallization from hydroxypropionic acid and apparatus therefor STOCKHAUSEN CHEM FAB GMBH (DE) 2009-09-09 — — CN disclosed
CN-101283095-A Microbiological production of 3-hydroxypropionic acid DEGUSSA (DE) 2008-10-08 — — CN disclosed
CN-1556855-A 3-hydroxypropionic acid and other organic compounds 卡吉尔公司 2004-12-22 — — 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 (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-20220347192-A1 PRENYLTRANSFERASE VARIANTS AND METHODS FOR PRODUCTION OF PRENYLATED AROMATIC COMPOUNDS FNTA, COASY, PCYT1A NAA50 85/4885CHAT 270/4885EP300 644/4885

“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.

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