⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29172920 | 0.94 | — | — | |
| SCHEMBL4953033 | 0.88 | — | — | |
| SCHEMBL29170856 | 0.83 | — | — | |
| SCHEMBL29234016 | 0.82 | — | — | |
| SCHEMBL303017 | 0.82 | — | — | |
| SCHEMBL3900036 | 0.76 | — | — | |
| SCHEMBL29009058 | 0.76 | — | — | |
| SCHEMBL13726269 | 0.76 | — | — | |
| SCHEMBL27542189 | 0.76 | — | — | |
| SCHEMBL18245691 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113099718-B | Imidazole/thiol polymerization initiation system | 登士柏希罗纳有限公司 | 2024-02-13 | — | — | CN | disclosed |
| CN-112638348-B | Method and composition for stabilizing nanogels and dental compositions produced from nanogels | 登士柏希罗纳有限公司 | 2023-10-24 | — | — | CN | disclosed |