⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL213695 | 0.95 | — | — | |
| SCHEMBL12005226 | 0.90 | — | — | |
| SCHEMBL29125637 | 0.90 | — | — | |
| SCHEMBL7901644 | 0.67 | — | — | |
| SCHEMBL28927623 | 0.63 | — | — | |
| SCHEMBL28203504 | 0.63 | — | — | |
| SCHEMBL1325220 | 0.60 | — | — | |
| SCHEMBL27597961 | 0.60 | — | — | |
| SCHEMBL8404251 | 0.60 | — | — | |
| SCHEMBL29041356 | 0.57 | — | — |
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-115505172-A | Halogen-free flame retardant and preparation method and application thereof | 广州市寅源新材料股份有限公司 | 2022-12-23 | — | — | CN | disclosed |