⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29234966 | 0.85 | KMT2A (0.77) | — | |
| SCHEMBL1276454 | 0.83 | KMT2A (0.65) | — | |
| SCHEMBL5806296 | 0.82 | KMT2A (0.40) | — | |
| SCHEMBL4807374 | 0.82 | — | — | |
| SCHEMBL6082936 | 0.71 | — | — | |
| SCHEMBL4118090 | 0.71 | — | — | |
| SCHEMBL6082975 | 0.71 | — | — | |
| SCHEMBL3497023 | 0.71 | — | — | |
| SCHEMBL11131196 | 0.69 | KMT2A (0.50) | — | |
| SCHEMBL8078444 | 0.69 | KMT2A (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023083576-A1 | PRECURSORS OF PHENOLIC FRAGRANT COMPOUNDS | GIVAUDAN SA (CH) | 2023-05-19 | — | — | WO | disclosed |
| CN-114174299-A | Degradation of Bruton's Tyrosine Kinase (BTK) by conjugation of BTK inhibitors to E3 ligase ligands and methods of use | 百济神州有限公司 | 2022-03-11 | — | — | CN | disclosed |
| US-6933288-B2 | Pyranosyl cytosines: pharmaceutical formulations and methods | ISIS PHARMACEUTICALS, INC. | 2005-08-23 | — | — | US | disclosed |
| US-20030216575-A1 | Novel pyranosyl cytosines: pharmaceutical formulations and methods | ISIS PHARMACEUTICALS, INC. | 2003-11-20 | — | — | US | disclosed |
| US-4044028-A | Preparation of α,β-unsaturated aldehydes or ketones | HOFFMANN-LA ROCHE INC. (US) | 1977-08-23 | — | — | US | disclosed |
| US-4000131-A | PROCESS FOR PREPARING EPOXIDE-CYCLOHEXYL COMPOUND AND RESULTANT COMPOUND | HOFFMANN-LA ROCHE INC. (US) | 1976-12-28 | — | — | US | disclosed |