⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL337074 | 0.96 | — | — | |
| SCHEMBL27688231 | 0.93 | — | — | |
| SCHEMBL27707597 | 0.93 | — | — | |
| SCHEMBL27631017 | 0.84 | — | — | |
| SCHEMBL27537356 | 0.84 | — | — | |
| Ethylbenzene SCHEMBL20979813 | 0.83 | — | — | |
| SCHEMBL10954159 | 0.81 | TP53 (0.32) | — | |
| SCHEMBL23803165 | 0.71 | — | — | |
| SCHEMBL27688236 | 0.69 | HPGD (0.33) | — | |
| SCHEMBL27472624 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101121764-B | Catalyst composition applied to production of syndiotactic polystyrene material | GRAND PACIFIC PETROCHEMICAL CORP | 2010-05-26 | — | — | CN | claimed |
| CN-101121764-A | Catalyst composition applied to production of syndiotactic polystyrene material | GRAND PACIFIC PETROCHEMICAL CO (CN) | 2008-02-13 | — | — | CN | claimed |
| CN-101121764-B | Catalyst composition applied to production of syndiotactic polystyrene material | GRAND PACIFIC PETROCHEMICAL CORP | 2010-05-26 | — | — | CN | disclosed |
| CN-101121764-A | Catalyst composition applied to production of syndiotactic polystyrene material | GRAND PACIFIC PETROCHEMICAL CO (CN) | 2008-02-13 | — | — | CN | disclosed |