⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4451308 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL919405 | 0.79 | ALDH1A1 (0.33) | — | |
| SCHEMBL9007647 | 0.78 | — | — | |
| SCHEMBL18091185 | 0.74 | GABRA1 (0.34) | — | |
| SCHEMBL4459255 | 0.73 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL2958450 | 0.72 | CA2 (0.33) | — | |
| SCHEMBL8376095 | 0.70 | ESR2 (0.36) | — | |
| SCHEMBL5154102 | 0.70 | GABRA1 (0.35) | — | |
| SCHEMBL3329301 | 0.70 | GABRA1 (0.32) | — | |
| SCHEMBL9301086 | 0.69 | ALDH1A1 (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090069171-A1 | Catalysts for olefin polymerization, process for production of the catalysts, and method for preservation thereof | JAPAN POLYPROPYLENE CORPORATION (JP) | 2009-03-12 | — | — | US | disclosed |
| EP-0907676-A1 | STABILIZER COMPOSITIONS | CLARIANT INTERNATIONAL LTD. (CH) | 1999-04-14 | — | — | EP | disclosed |
| WO-1997049758-A1 | STABILIZER COMPOSITIONS | CLARIANT INTERNATIONAL LIMITED (CH) | 1997-12-31 | — | — | WO | disclosed |