⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17293173 | 0.84 | — | — | |
| SCHEMBL5824297 | 0.76 | MEN1 (0.32) | — | |
| SCHEMBL28907130 | 0.71 | MYC (0.39) | — | |
| SCHEMBL28515923 | 0.70 | GPR3 (0.38) | — | |
| SCHEMBL5076754 | 0.69 | ALDH1A1 (0.41) | — | |
| SCHEMBL29006439 | 0.69 | CTSL (0.33) | — | |
| SCHEMBL28515390 | 0.65 | NPC1 (0.38) | — | |
| SCHEMBL7469996 | 0.65 | ALDH1A1 (0.38) | — | |
| SCHEMBL28521719 | 0.65 | HSD11B1 (0.41) | — | |
| SCHEMBL28515419 | 0.64 | NPC1 (0.39) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109824802-A | Metallocenic compound, catalyst system and the polymerization using them of bridging | 埃克森美孚化学专利公司 | 2019-05-31 | — | — | CN | claimed |
| CN-108137729-B | Catalysts for forming multimodal polymers | 埃克森美孚化学专利公司 | 2021-02-05 | — | — | CN | disclosed |
| CN-109824802-A | Metallocenic compound, catalyst system and the polymerization using them of bridging | 埃克森美孚化学专利公司 | 2019-05-31 | — | — | CN | disclosed |
| CN-108137729-A | It is used to form the catalyst of multimodal polymer | 埃克森美孚化学专利公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-104822697-A | Bridged metallocene compounds, catalyst systems and polymerization processes using the same | EXXONMOBIL CHEM PATENTS INC | 2015-08-05 | — | — | CN | disclosed |