⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28804847 | 0.91 | NFKB1 (0.36) | — | |
| SCHEMBL28804768 | 0.89 | NFKB1 (0.33) | — | |
| SCHEMBL28804843 | 0.87 | — | — | |
| SCHEMBL28804683 | 0.79 | — | — | |
| SCHEMBL28804844 | 0.79 | — | — | |
| SCHEMBL28804571 | 0.78 | SLC18A2 (0.34) | — | |
| SCHEMBL28486815 | 0.74 | — | — | |
| SCHEMBL21244330 | 0.74 | — | — | |
| SCHEMBL28804830 | 0.74 | CDC25B (0.32) | — | |
| SCHEMBL28804515 | 0.74 | HTR6 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114845980-A | Dimer-selective metallocene catalyst, non-aromatic hydrocarbon soluble activator and method for preparing poly alpha-olefin oligomer using the same | 埃克森美孚化学专利公司 | 2022-08-02 | — | — | CN | claimed |
| CN-114845980-A | Dimer-selective metallocene catalyst, non-aromatic hydrocarbon soluble activator and method for preparing poly alpha-olefin oligomer using the same | 埃克森美孚化学专利公司 | 2022-08-02 | — | — | CN | disclosed |