⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23740 | 0.74 | — | — | |
| SCHEMBL835952 | 0.70 | — | — | |
| SCHEMBL28800054 | 0.70 | — | — | |
| SCHEMBL10306576 | 0.67 | — | — | |
| SCHEMBL12029487 | 0.67 | — | — | |
| SCHEMBL12512938 | 0.67 | — | — | |
| SCHEMBL139597 | 0.67 | — | — | |
| SCHEMBL212389 | 0.67 | — | — | |
| SCHEMBL27181793 | 0.67 | — | — | |
| SCHEMBL12969457 | 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-108484812-B | High-syndiotactic-stereospecific functionalized polystyrene polymer and preparation method thereof | 中国科学院长春应用化学研究所 | 2019-12-13 | — | — | CN | disclosed |