⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6439203 | 0.95 | — | — | |
| SCHEMBL6438311 | 0.67 | — | — | |
| SCHEMBL31208072 | 0.67 | — | — | |
| Ether SCHEMBL23611026 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL6434600 | 0.63 | — | — | |
| Ether SCHEMBL21406 | 0.59 | ALDH1A1 (0.47) | — | |
| Ether SCHEMBL6 | 0.59 | — | — | |
| SCHEMBL1473 | 0.59 | — | — | |
| SCHEMBL27065 | 0.59 | — | — | |
| Ether SCHEMBL9248046 | 0.59 | ALDH1A1 (0.47) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1238989-B1 | Olefin polymerization catalyst and process for producing olefin polymer with the catalyst | MITSUI CHEMICALS INC (JP) | 2015-10-07 | — | — | EP | disclosed |
| US-6897176-B2 | Olefin polymerization catalyst and process for producing olefin polymer with the catalyst | MITSUI CHEMICALS, INC. (JP) | 2005-05-24 | — | — | US | disclosed |
| CN-1112966-C | Supported catalyst contg. platinum roup metal and method for producing diarylcarbonates | BAYER AG (DE) | 2003-07-02 | — | — | CN | disclosed |
| US-20020169072-A1 | Olefin polymerization catalyst and process for produing Olefin polymer with the catalyst | MITSUI CHEMICALS, INC. (JP) | 2002-11-14 | — | — | US | disclosed |
| EP-1238989-A2 | Olefin polymerization catalyst and process for producing olefin polymer with the catalyst | Mitsui Chemicals, Inc. (JP) | 2002-09-11 | — | — | EP | disclosed |
| CN-1267235-A | Supported catalyst contg. platinum roup metal and method for producing diarylcarbonates | BAYER AG (DE) | 2000-09-20 | — | — | CN | disclosed |