⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15940316 | 0.79 | — | — | |
| SCHEMBL17689261 | 0.71 | — | — | |
| SCHEMBL4622811 | 0.71 | — | — | |
| SCHEMBL12693391 | 0.69 | KDM4E (0.31) | — | |
| SCHEMBL11080149 | 0.69 | — | — | |
| SCHEMBL8136891 | 0.67 | — | — | |
| SCHEMBL12690040 | 0.67 | — | — | |
| SCHEMBL14788340 | 0.62 | — | — | |
| SCHEMBL14905171 | 0.61 | — | — | |
| SCHEMBL20500086 | 0.58 | ALDH1A1 (0.32) | — |
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-5986113-A | MULTISTAGE PROCESS FOR FORMING PIGMENTS | ROCHE VITAMINS INC (US) | 1999-11-16 | — | — | US | claimed |
| CN-116120218-B | Beta-apo-8’Process for preparing ethyl carotenoate | 万华化学集团股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-116120218-A | Beta-apo-8 ’ Process for preparing ethyl carotenoate | 万华化学集团股份有限公司 | 2023-05-16 | — | — | CN | disclosed |
| US-9656974-B2 | Oxazine derivatives | SHIONOGI & CO., LTD. (JP) | 2017-05-23 | — | — | US | disclosed |
| US-20140127130-A1 | Radiofluorinated compounds and their preparation | HAMMERSMITH IMANET LIMITED (GB) | 2014-05-08 | — | — | US | disclosed |
| US-20110155976-A1 | ULTRAVIOLET ABSORBENT COMPOSITION | FUJIFILM CORPORATION (JP) | 2011-06-30 | — | — | US | disclosed |
| CN-1133643-C | Lactone derivatives of 17-beta-carboxy, carbothio and amide androstane derivatives | — | 2004-01-07 | — | — | CN | disclosed |
| CN-1124261-C | Manufacture of polyene esters and acids | HOFFMANN LA ROCHE (CH) | 2003-10-15 | — | — | CN | disclosed |
| EP-0814078-B1 | Process for the preparation of polyenic esters and -acids | HOFFMANN LA ROCHE (CH) | 2000-04-05 | — | — | EP | disclosed |
| US-5986113-A | MULTISTAGE PROCESS FOR FORMING PIGMENTS | ROCHE VITAMINS INC (US) | 1999-11-16 | — | — | US | disclosed |
| CN-1209135-A | Lactone derivatives of 17-beta-carboxy, carbothio and amide androstane derivatives | GLAXO GROUP LTD (GB) | 1999-02-24 | — | — | CN | disclosed |
| US-5763651-A | CONDENSATION OF UNSATURATED ETHERS IN THE PRESENCE OF LEWIS ACIDS | ROCHE VITAMINS INC. (US) | 1998-06-09 | — | — | US | disclosed |
| CN-1169418-A | Manufacture of polyene esters and acids | HOFFMANN LA ROCHE (CH) | 1998-01-07 | — | — | CN | disclosed |
| EP-0814078-A1 | Process for the preparation of polyenic esters and -acids | F. HOFFMANN-LA ROCHE AG (CH) | 1997-12-29 | — | — | EP | disclosed |
| EP-0648769-A1 | 12-Hetero-substituted 6,11-ethano-6,11-dihydrobenzo[b] quinolizium salts and compositions and method of use thereof | STERLING WINTHROP INC. (US) | 1995-04-19 | — | — | EP | disclosed |
| US-5380729-A | Treatment or prevention of neurodegenerative disorders or neurotoxic injuries | STERLING WINTHROP INC. (US) | 1995-01-10 | — | — | US | disclosed |
| US-4466903-A | Unsaturated 1,3-dioxolane stabilized with aliphatic aldehyde hydrazone | PPG INDUSTRIES, INC. (US) | 1984-08-21 | — | — | US | disclosed |
| US-4418231-A | ACID ACCEPTING 2-ALKYLIDENE-1,3-DIOXOLANES IN TRICHLOROETHYLENE AND/OR METHYLCHLOROFORM | PPG INDUSTRIES, INC. (US) | 1983-11-29 | — | — | US | disclosed |