⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4451352 | 0.85 | — | — | |
| SCHEMBL9853264 | 0.69 | — | — | |
| SCHEMBL1996789 | 0.67 | — | — | |
| SCHEMBL5033005 | 0.66 | — | — | |
| SCHEMBL28481304 | 0.66 | — | — | |
| Iodide SCHEMBL28635450 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL28527482 | 0.65 | — | — | |
| Bromide SCHEMBL27950999 | 0.65 | — | — | |
| SCHEMBL4797725 | 0.62 | — | — | |
| SCHEMBL9449651 | 0.62 | — | — |
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-111004364-A | Preparation method of reactive halogen-free nitrogen-phosphorus flame retardant | 南京晨化新材料科技有限公司 | 2020-04-14 | — | — | CN | disclosed |