⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10923534 | 0.98 | ALDH1A1 (0.30) | — | |
| SCHEMBL7711936 | 0.79 | CYP19A1 (0.32) | — | |
| SCHEMBL15475655 | 0.78 | ADRA2A (0.31) | — | |
| SCHEMBL17929082 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL15475696 | 0.77 | CHRM3 (0.30) | — | |
| SCHEMBL34468751 | 0.77 | — | — | |
| SCHEMBL31408699 | 0.76 | — | — | |
| SCHEMBL11303860 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL16113295 | 0.75 | — | — | |
| SCHEMBL21814345 | 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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4518805-A | HYDROFORMYLATION TO ETHER ALDEHYDE, BOROHYDRIDE, RHODIUM CATALYST | UNION CARBIDE CORPORATION (US) | 1985-05-21 | — | — | US | claimed |
| EP-0060523-B1 | PROCESS FOR REMOVING HYDROPEROXIDES AND ALDEHYDES FROM ALLYL-ALKYL ETHER | UNION CARBIDE CORPORATION (US) | 1984-07-18 | — | — | EP | claimed |
| EP-0060523-A1 | Process for removing hydroperoxides and aldehydes from allyl-alkyl ether | UNION CARBIDE CORPORATION (US) | 1982-09-22 | — | — | EP | claimed |
| US-4518805-A | HYDROFORMYLATION TO ETHER ALDEHYDE, BOROHYDRIDE, RHODIUM CATALYST | UNION CARBIDE CORPORATION (US) | 1985-05-21 | — | — | US | disclosed |
| US-4503275-A | FROM ALLYL ALCOHOL AND AN OLEFIN | DAVY MCKEE (LONDON) LIMITED (GB) | 1985-03-05 | — | — | US | disclosed |
| EP-0060523-B1 | PROCESS FOR REMOVING HYDROPEROXIDES AND ALDEHYDES FROM ALLYL-ALKYL ETHER | UNION CARBIDE CORPORATION (US) | 1984-07-18 | — | — | EP | disclosed |
| EP-0018164-B1 | PRODUCTION OF TETRAHYDROFURAN | DAVY McKEE (LONDON) LIMITED (GB) | 1984-07-11 | — | — | EP | disclosed |
| US-4414420-A | CATALYTIC HYDROFORMYLATION OF CORRESPONDING UNSATURATED ETHER | DAVY MCKEE (OIL & CHEMICALS) LIMITED (GB) | 1983-11-08 | — | — | US | disclosed |
| EP-0018161-B1 | ALDEHYDE-ETHERS AND PROCESS FOR THEIR PRODUCTION | DAVY McKEE (LONDON) LIMITED (GB) | 1983-05-25 | — | — | EP | disclosed |
| US-4383125-A | CHEMICAL INTERMEDIATES FOR 6-BUTYROLACTONE, 1,4-BUTANEDIOL, AND TETRAHYDROFURAN | DAVY MCKEE (OIL & CHEMICALS) LIMITED (GB) | 1983-05-10 | — | — | US | disclosed |
| EP-0018163-B1 | PRODUCTION OF BUTANE-1,4-DIOL | DAVY McKEE (LONDON) LIMITED (GB) | 1983-03-16 | — | — | EP | disclosed |
| EP-0060523-A1 | Process for removing hydroperoxides and aldehydes from allyl-alkyl ether | UNION CARBIDE CORPORATION (US) | 1982-09-22 | — | — | EP | disclosed |
| US-4302394-A | OXIDATION OF AN ALKOXYBUTYRALDYHYDE TO THE CARBOXYLIC ACID, DEETHERIFICATION, CYCLIZATION | DAVY MCKEE (OIL & CHEMICALS) LIMITED (GB) | 1981-11-24 | — | — | US | disclosed |
| US-4287127-A | Production of tetrahydrofuran | DAVY MCKEE (OIL & CHEMICALS) LIMITED (GB) | 1981-09-01 | — | — | US | disclosed |
| EP-0018161-A1 | Aldehyde-ethers and process for their production | DAVY McKEE (LONDON) LIMITED (GB) | 1980-10-29 | — | — | EP | disclosed |
| EP-0018163-A1 | Production of butane-1,4-diol | DAVY McKEE (LONDON) LIMITED (GB) | 1980-10-29 | — | — | EP | disclosed |
| EP-0018164-A1 | Production of tetrahydrofuran | DAVY McKEE (LONDON) LIMITED (GB) | 1980-10-29 | — | — | EP | disclosed |
| EP-0018162-A1 | Production of butyrolactone | DAVY McKEE (LONDON) LIMITED (GB) | 1980-10-29 | — | — | EP | disclosed |