⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2380315 | 0.84 | MEN1 (0.32) | — | |
| SCHEMBL2380317 | 0.84 | MEN1 (0.32) | — | |
| SCHEMBL2381805 | 0.84 | MEN1 (0.32) | — | |
| SCHEMBL2381801 | 0.84 | MEN1 (0.32) | — | |
| SCHEMBL2380320 | 0.84 | MEN1 (0.32) | — | |
| SCHEMBL23236796 | 0.81 | MEN1 (0.33) | — | |
| SCHEMBL29926037 | 0.81 | MEN1 (0.31) | — | |
| SCHEMBL16314440 | 0.78 | MEN1 (0.31) | — | |
| SCHEMBL9405647 | 0.78 | MEN1 (0.31) | — | |
| SCHEMBL9405664 | 0.78 | MEN1 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240409480-A1 | HALOALKYL ALKOXYMETHYL ETHER COMPOUND, AND PROCESS FOR PREPARING 4,6,8,10,16-PENTAMETHYLDOCOSANE THEREFROM AND FOR PREPARING SYNTHETIC INTERMEDIATE THEREFOR | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2024-12-12 | — | — | US | disclosed |
| CN-119059889-A | Haloalkylalkoxymethyl ether compound, process for producing 4,6,8,10,16-pentamethylbehene therefrom, and process for producing synthetic intermediate thereof | 信越化学工业株式会社 | 2024-12-03 | — | — | CN | disclosed |