⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5081773 | 0.94 | APEX1 (0.33) | — | |
| SCHEMBL5080888 | 0.86 | APP (0.31) | — | |
| SCHEMBL5082283 | 0.84 | PDK2 (0.30) | — | |
| SCHEMBL5940617 | 0.83 | PDK2 (0.38) | — | |
| SCHEMBL5080869 | 0.81 | APEX1 (0.35) | — | |
| SCHEMBL5085336 | 0.81 | PDK2 (0.33) | — | |
| SCHEMBL5078674 | 0.81 | APEX1 (0.35) | — | |
| SCHEMBL29415598 | 0.78 | APEX1 (0.42) | — | |
| SCHEMBL233774 | 0.78 | APEX1 (0.42) | — | |
| SCHEMBL5080910 | 0.77 | ALDH1A1 (0.35) | — |
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-20060142146-A1 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION | 2006-06-29 | — | — | US | claimed |
| US-7323431-B2 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION (CN) | 2008-01-29 | — | — | US | disclosed |
| US-20060142146-A1 | Catalyst for olefin polymerization and use of the same | CHINA PETROLEUM & CHEMICAL CORPORATION | 2006-06-29 | — | — | US | disclosed |