⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5081794 | 0.92 | ESR1 (0.31) | — | |
| SCHEMBL5078119 | 0.90 | — | — | |
| SCHEMBL5080789 | 0.88 | — | — | |
| SCHEMBL5075131 | 0.82 | — | — | |
| SCHEMBL5080752 | 0.82 | ALDH1A1 (0.32) | — | |
| SCHEMBL5075166 | 0.79 | — | — | |
| SCHEMBL5077317 | 0.78 | — | — | |
| SCHEMBL5081486 | 0.75 | DUT (0.30) | — | |
| SCHEMBL5078722 | 0.75 | ALDH1A1 (0.31) | — | |
| SCHEMBL5078216 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7323431-B2 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2008-01-29 | — | — | US | claimed |
| US-20060142146-A1 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION | 2006-06-29 | — | — | US | claimed |
| US-7399812-B2 | Silicon ether compounds and a method for the preparation thereof | CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2008-07-15 | — | — | US | disclosed |
| US-7323431-B2 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2008-01-29 | — | — | US | disclosed |
| US-20060183873-A1 | Silicon ether compounds and a method for the preparation thereof | BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2006-08-17 | — | — | US | disclosed |
| US-20060142146-A1 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION | 2006-06-29 | — | — | US | disclosed |