⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8675570 | 0.80 | — | — | |
| SCHEMBL28726711 | 0.73 | — | — | |
| SCHEMBL28632693 | 0.69 | — | — | |
| SCHEMBL28641256 | 0.68 | — | — | |
| SCHEMBL29259734 | 0.66 | — | — | |
| SCHEMBL29116979 | 0.64 | — | — | |
| SCHEMBL28501336 | 0.64 | — | — | |
| SCHEMBL28591278 | 0.60 | — | — | |
| SCHEMBL18140297 | 0.60 | — | — | |
| SCHEMBL23071323 | 0.60 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260353-A | Acrylate polymerization reaction method based on cooperative regulation and control of hydrogen bond and Lewis acid | 青岛大学 | 2022-11-01 | — | — | CN | disclosed |