⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27529971 | 0.85 | ALOX15 (0.61) | — | |
| SCHEMBL10612243 | 0.84 | — | — | |
| SCHEMBL7095968 | 0.78 | — | — | |
| SCHEMBL12837120 | 0.78 | — | — | |
| SCHEMBL5052737 | 0.77 | — | — | |
| SCHEMBL14564890 | 0.76 | — | — | |
| SCHEMBL969523 | 0.76 | — | — | |
| SCHEMBL6436099 | 0.74 | — | — | |
| SCHEMBL502333 | 0.74 | — | — | |
| SCHEMBL28699828 | 0.74 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113646290-B | Process for recovering 3-methyl-but-3-en-1-ol | 巴斯夫欧洲公司 | 2024-05-07 | — | — | CN | disclosed |
| EP-3941894-B1 | PROCESS TO RECOVER 3-METHYL-BUT-3-EN-1-OL | BASF SE (DE) | 2023-11-08 | — | — | EP | disclosed |
| US-11618725-B2 | Process to recover 3-methyl-but-3-en-1-ol | BASF SE (DE) | 2023-04-04 | — | — | US | disclosed |
| US-20220169586-A1 | PROCESS TO RECOVER 3-METHYL-BUT-3-EN-1-OL | BASF SE (DE) | 2022-06-02 | — | — | US | disclosed |
| EP-3941894-A1 | PROCESS TO RECOVER 3-METHYL-BUT-3-EN-1-OL | BASF SE (DE) | 2022-01-26 | — | — | EP | disclosed |
| CN-113646290-A | Process for recovering 3-methyl-but-3-en-1-ol | 巴斯夫欧洲公司 | 2021-11-12 | — | — | CN | disclosed |
| WO-2020187953-A1 | PROCESS TO RECOVER 3-METHYL-BUT-3-EN-1-OL | BASF SE (DE) | 2020-09-24 | — | — | WO | disclosed |
| US-5639894-A | REACTING NEROLIDOL, FARNESOL, OR THEIR MONOCYCLIC ANALOGUES WITH CARBON MONOXIDE IN PRESENCE OF PALLADIUM HALIDE CATALYSTS, REDUCING THE INTERMEDIATE EITHER ACID OR ESTER FORM TO ALCOHOL FORM, AND CYCLIZING WITH ACID CATALYST | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1997-06-17 | — | — | US | disclosed |
| EP-0553205-B1 | CARBONYLATION OF ALLYLIC ALCOHOLS AND SYNTHESIS OF AN AMBERGRIS FRAGRANCE COMPOUND | HENKEL RESEARCH CORP (US) | 1996-04-10 | — | — | EP | disclosed |
| US-5326888-A | Reacting with carbon monoxide using palladium halide catalyst; reduction, cyclization | HENKEL RESEARCH CORPORATION (US) | 1994-07-05 | — | — | US | disclosed |
| EP-0553205-A1 | CARBONYLATION OF ALLYLIC ALCOHOLS AND SYNTHESIS OF AN AMBERGRIS FRAGRANCE COMPOUND. | HENKEL RESEARCH CORP (US) | 1993-08-04 | — | — | EP | disclosed |
| WO-1992006063-A2 | CARBONYLATION OF ALLYLIC ALCOHOLS AND SYNTHESIS OF AN AMBERGRIS FRAGRANCE COMPOUND | HENKEL RESEARCH CORPORATION (US) | 1992-04-16 | — | — | WO | disclosed |
| EP-0036160-B1 | PROCESS FOR THE PREPARATION OF 2-HYDROXYALKYL CHROMANES | BASF Aktiengesellschaft (DE) | 1983-05-11 | — | — | EP | disclosed |
| US-4344886-A | ETHERIFICATION, ALKYLATION, LEWIS ACID CATALYSTS | BASF AKTIENGESELLSCHAFT (DE) | 1982-08-17 | — | — | US | disclosed |
| EP-0036160-A1 | Process for the preparation of 2-hydroxyalkyl chromanes | BASF Aktiengesellschaft (DE) | 1981-09-23 | — | — | EP | disclosed |
| US-3953518-A | Process for preparing γ, δ-unsaturated carbonyl compounds | HOFFMANN-LA ROCHE INC. (US) | 1976-04-27 | — | — | US | disclosed |