⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31590820 | 0.84 | CTSK (0.37) | — | |
| SCHEMBL31590641 | 0.83 | RGS12 (0.32) | — | |
| SCHEMBL31590613 | 0.79 | GABBR2 (0.38) | — | |
| SCHEMBL31590899 | 0.78 | LPAR3 (0.45) | — | |
| SCHEMBL8830889 | 0.77 | TSHR (0.66) | — | |
| SCHEMBL31590484 | 0.77 | LPAR3 (0.48) | — | |
| SCHEMBL31590789 | 0.77 | LPAR3 (0.48) | — | |
| SCHEMBL31590492 | 0.77 | LPAR3 (0.48) | — | |
| SCHEMBL31590201 | 0.73 | — | — | |
| SCHEMBL31590359 | 0.70 | HPGD (0.46) | — |
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-120040637-A | Organic phosphonic acid polymer flame retardant, and preparation method and application thereof | 威海海润新材料科技有限公司 | 2025-05-27 | — | — | CN | disclosed |