⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL967774 | 0.97 | — | — | |
| SCHEMBL29240018 | 0.94 | — | — | |
| SCHEMBL214833 | 0.69 | — | — | |
| SCHEMBL7117810 | 0.69 | — | — | |
| SCHEMBL8463337 | 0.67 | — | — | |
| SCHEMBL2656434 | 0.67 | — | — | |
| Methane SCHEMBL9705790 | 0.67 | — | — | |
| SCHEMBL19574670 | 0.65 | — | — | |
| SCHEMBL28390060 | 0.65 | — | — | |
| SCHEMBL13651447 | 0.65 | — | — |
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-106700538-A | Wholly aromatic polyamide artificial leather flame-retardant composition based on zinc di (diisopropyl hypophosphite) and preparation method thereof | 无锡华联塑料制品有限公司 | 2017-05-24 | — | — | CN | disclosed |