⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5606547 | 1.00 | — | — | |
| SCHEMBL5607769 | 1.00 | — | — | |
| SCHEMBL5606846 | 1.00 | — | — | |
| SCHEMBL5607503 | 1.00 | — | — | |
| SCHEMBL5607637 | 0.96 | — | — | |
| SCHEMBL5607496 | 0.84 | — | — | |
| SCHEMBL2405628 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL6693744 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL8568629 | 0.78 | ALDH1A1 (0.33) | — | |
| SCHEMBL3535287 | 0.78 | ALDH1A1 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7202316-B2 | Modified particle, catalyst component for addition polymerization, catalyst for addition polymerization and process for producing addition polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-04-10 | — | — | US | disclosed |
| US-20050192178-A1 | Modified particle, catalyst component for addition polymerization, catalyst for addition polymerization and process for producing addition polymer | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2005-09-01 | — | — | US | disclosed |