⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1692342 | 0.90 | — | — | |
| SCHEMBL29466987 | 0.82 | CA12 (0.39) | — | |
| SCHEMBL29466988 | 0.81 | CA12 (0.38) | — | |
| SCHEMBL2552165 | 0.80 | — | — | |
| SCHEMBL16989259 | 0.80 | — | — | |
| SCHEMBL432262 | 0.79 | LMNA (0.31) | — | |
| SCHEMBL4292978 | 0.78 | ALDH1A1 (0.31) | — | |
| SCHEMBL5028336 | 0.77 | LMNA (0.34) | — | |
| SCHEMBL6574221 | 0.77 | — | — | |
| SCHEMBL35210071 | 0.76 | LMNA (0.37) | — |
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-117603505-A | Organic/inorganic multi-component composite halogen-free flame retardant, and preparation method and application thereof | 广东石油化工学院 | 2024-02-27 | — | — | CN | claimed |
| CN-117603505-A | Organic/inorganic multi-component composite halogen-free flame retardant, and preparation method and application thereof | 广东石油化工学院 | 2024-02-27 | — | — | CN | disclosed |