⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8984014 | 0.71 | — | — | |
| SCHEMBL9856617 | 0.70 | THRB (0.32) | — | |
| SCHEMBL6652488 | 0.66 | TSHR (0.40) | — | |
| SCHEMBL23430354 | 0.60 | — | — | |
| SCHEMBL9865125 | 0.59 | — | — | |
| SCHEMBL149796 | 0.59 | — | — | |
| Acrylic Acid SCHEMBL11119894 | 0.57 | LMNA (0.53) | — | |
| SCHEMBL6425142 | 0.56 | — | — | |
| SCHEMBL22265061 | 0.54 | — | — | |
| SCHEMBL22265064 | 0.54 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5639883-A | Process for preparing substituted 4-methylidenecinnamic acid derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-06-17 | — | — | US | claimed |
| EP-0263492-B1 | RETINOIDS, THEIR PREPARATION AND USE AS PHARMACEUTICAL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-03-13 | — | — | EP | claimed |
| EP-0263492-A1 | Retinoids, their preparation and use as pharmaceutical compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1988-04-13 | — | — | EP | claimed |
| CN-111273489-B | Liquid crystal display device and method of manufacturing the same | 乐金显示有限公司 | 2023-02-17 | — | — | CN | disclosed |
| CN-111273489-A | Liquid crystal display device and method of manufacturing the same | 乐金显示有限公司 | 2020-06-12 | — | — | CN | disclosed |
| CN-108471740-A | Degradable packaging film for fruits and vegetables | 智利圣地亚哥大学 | 2018-08-31 | — | — | CN | disclosed |