⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL124683 | 1.00 | — | — | |
| SCHEMBL183038 | 1.00 | — | — | |
| SCHEMBL28040463 | 1.00 | — | — | |
| SCHEMBL2985745 | 1.00 | — | — | |
| SCHEMBL22162 | 1.00 | — | — | |
| SCHEMBL283825 | 1.00 | — | — | |
| SCHEMBL3427685 | 1.00 | ALDH1A1 (0.62) | — | |
| Isopropyl Alcohol SCHEMBL10704262 | 0.94 | ALDH1A1 (0.75) | — | |
| Water SCHEMBL18210533 | 0.94 | — | — | |
| Methane SCHEMBL15522521 | 0.94 | — | — |
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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114075526-B | Genetically engineered bacterium for efficiently producing (2S, 3S) -2, 3-butanediol, construction method and application thereof | 齐鲁工业大学 | 2023-09-05 | — | — | CN | claimed |
| CN-106794122-B | Compositions containing meso-2, 3-butanediol | 株式会社爱茉莉太平洋 | 2020-09-25 | — | — | CN | claimed |
| CN-106337068-A | Butanedione reductase application | 广西科学院 | 2017-01-18 | — | — | CN | claimed |
| CN-102154384-B | Method for producing chiral pure (2S,3S)-2,3-butanediol | UNIV SHANDONG | 2013-03-06 | — | — | CN | claimed |
| CN-117384868-A | Engineered ketoreductase and method for preparing chiral alcohol compounds | 宁波酶赛生物工程有限公司 | 2024-01-12 | — | — | CN | disclosed |
| CN-116947925-A | Bridged biphenyl monophosphine ligand containing benzofuran structure, and preparation method and application thereof | 中山大学 | 2023-10-27 | — | — | CN | disclosed |
| CN-116940552-A | Spirocyclic hexane derivatives, pharmaceutical compositions containing them and their use as anti-apoptotic inhibitors | 法国施维雅药厂 | 2023-10-24 | — | — | CN | disclosed |
| CN-114075526-B | Genetically engineered bacterium for efficiently producing (2S, 3S) -2, 3-butanediol, construction method and application thereof | 齐鲁工业大学 | 2023-09-05 | — | — | CN | disclosed |
| CN-109563471-B | Bacterial strains producing 2,3-butanediol and other metabolites | 腾亚研创 | 2023-02-14 | — | — | CN | disclosed |
| EP-4021430-A1 | TREATMENT OF OBESITY AND RELATED CONDITIONS | University of Greenwich (GB) | 2022-07-06 | — | — | EP | disclosed |
| CN-113186144-A | Recombinant microorganisms and uses thereof | 朗泽科技新西兰有限公司 | 2021-07-30 | — | — | CN | disclosed |
| CN-113186144-A | Recombinant microorganisms and uses thereof | 朗泽科技新西兰有限公司 | 2021-07-30 | — | — | CN | disclosed |
| US-20130330809-A1 | Recombinant microorganisms and uses therefor | LANZATECH NEW ZEALAND LIMITED (NZ) | 2013-12-12 | — | — | US | disclosed |
| US-20130330809-A1 | Recombinant microorganisms and uses therefor | LANZATECH NEW ZEALAND LIMITED (NZ) | 2013-12-12 | — | — | US | disclosed |
| WO-2013185123-A1 | RECOMBINANT MICROORGANISMS AND USES THEREFOR | LANZATECH NEW ZEALAND LIMITED (NZ) | 2013-12-12 | — | — | WO | disclosed |
| US-20130303526-A1 | Pyridine Compounds and the Uses Thereof | PURDUE PHARMA L.P. (US) | 2013-11-14 | — | — | US | disclosed |
| WO-2013076144-A2 | MICROORGANISM STRAINS FOR THE PRODUCTION OF 2,3-BUTANEDIOL | METABOLIC EXPLORER (FR) | 2013-05-30 | — | — | WO | disclosed |
| CN-103080059-A | Method for the continuous production of 2-butanone in hot pressurized water having an added electrolyte | WACKER CHEMIE AG | 2013-05-01 | — | — | CN | disclosed |
| WO-2012035421-A2 | PYRIDINE COMPOUNDS AND THE USES THEREOF | PURDUE PHARMA L.P. (US) | 2012-03-22 | — | — | WO | disclosed |
| US-20080319195-A1 | Enantioselective Preparation of Benzimidazole Derivatives and Their Salts | RATIOPHARM GMBH (DE) | 2008-12-25 | — | — | US | disclosed |