⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2029 | 0.93 | — | — | |
| SCHEMBL4591460 | 0.93 | — | — | |
| SCHEMBL3684134 | 0.86 | — | — | |
| SCHEMBL7907603 | 0.86 | — | — | |
| SCHEMBL7592419 | 0.86 | — | — | |
| SCHEMBL23452072 | 0.86 | — | — | |
| SCHEMBL22471971 | 0.86 | — | — | |
| SCHEMBL20636754 | 0.86 | — | — | |
| SCHEMBL20636756 | 0.86 | — | — | |
| SCHEMBL8781203 | 0.86 | — | — |
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 49 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113816835-A | Method for coproducing dimethyl decyne diol and methyl hexine alcohol | 四川众邦制药有限公司 | 2021-12-21 | — | — | CN | claimed |
| CN-113717031-A | Method for coproducing tetramethyldodecynediol and dimethylheptynediol | 四川众邦制药有限公司 | 2021-11-30 | — | — | CN | claimed |
| CN-113698274-A | Method for synthesizing 3-butyne-2-ol with high yield | 四川众邦制药有限公司 | 2021-11-26 | — | — | CN | claimed |
| CN-113666803-A | Method for synthesizing propiolic alcohol | 四川众邦制药有限公司 | 2021-11-19 | — | — | CN | claimed |
| CN-113101937-A | Doped mixed-valence copper catalyst and preparation method and application thereof | 厦门大学 | 2021-07-13 | — | — | CN | claimed |
| CN-107820488-A | Polymer additive and method for preparing same | 科莱恩塑料和涂料有限公司 | 2018-03-20 | — | — | CN | claimed |
| US-7931944-B2 | Controlling infection in fabrics | KIMBERLY-CLARK WORLDWIDE, INC. (US) | 2011-04-26 | — | — | US | claimed |
| CN-1325452-C | Method for synthesizing alkynol by ketone and acetylene | CHINA PETROLEUM & CHEMICAL (CN) | 2007-07-11 | — | — | CN | claimed |
| CN-1769254-A | Method for synthesizing alkynol by ketone and acetylene | CHINA PETROLEUM & CHEMICAL (CN) | 2006-05-10 | — | — | CN | claimed |
| CN-108787177-B | Method and system for preparing xanthate by slurry method | 中南大学 | 2024-03-15 | — | — | CN | disclosed |
| US-20240076258-A1 | METHOD FOR PRODUCING ISOBUTYL VINYL ETHER AND METHOD FOR PURIFYING ISOBUTYL VINYL ETHER | MARUZEN PETROCHEMICAL CO., LTD. (JP) | 2024-03-07 | — | — | US | disclosed |
| EP-4289809-A1 | METHOD FOR PRODUCING ISOBUTYL VINYL ETHER AND METHOD FOR PURIFYING ISOBUTYL VINYL ETHER | Maruzen Petrochemical Co., Ltd. (JP) | 2023-12-13 | — | — | EP | disclosed |
| CN-110467519-B | Ethynylation method | 万华化学集团股份有限公司 | 2022-08-05 | — | — | CN | disclosed |
| CN-113880691-A | Method for synthesizing trimethyl dodecynol | 四川众邦制药有限公司 | 2022-01-04 | — | — | CN | disclosed |
| CN-1325452-C | Method for synthesizing alkynol by ketone and acetylene | CHINA PETROLEUM & CHEMICAL (CN) | 2007-07-11 | — | — | CN | disclosed |
| CN-1769254-A | Method for synthesizing alkynol by ketone and acetylene | CHINA PETROLEUM & CHEMICAL (CN) | 2006-05-10 | — | — | CN | disclosed |
| CN-1246488-C | Process for selective removal of molybdenum from liquid mixtures containing molybdenum and vanadium | ENITECNOLOGIE SPA (IT) | 2006-03-22 | — | — | CN | disclosed |
| CN-1335839-A | Bis-sulfonamides | ACTELION PHARMACEUTICALS LTD (CH) | 2002-02-13 | — | — | CN | disclosed |
| CN-1067999-C | Anti-helicobacter heterocyclic derivatives of azolines | JANSSEN PHARMACEUTICA NV (BE) | 2001-07-04 | — | — | CN | disclosed |
| CN-1152310-A | Anti-helicobacter heterocyclic derivatives of azolines | JANSSEN PHARMACEUTICA NV (BE) | 1997-06-18 | — | — | CN | disclosed |