⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL28944567 | 0.92 | — | — | |
| SCHEMBL1392281 | 0.88 | — | — | |
| SCHEMBL1392984 | 0.88 | — | — | |
| Magnesium Chloride Anhydrous SCHEMBL23302967 | 0.87 | — | — | |
| SCHEMBL4527949 | 0.86 | — | — | |
| SCHEMBL578629 | 0.86 | — | — | |
| SCHEMBL4838682 | 0.86 | — | — | |
| SCHEMBL8064647 | 0.86 | — | — | |
| SCHEMBL5042552 | 0.80 | — | — | |
| SCHEMBL5042965 | 0.80 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114761414-A | Non-coordinating anion activators containing cations with long chain alkoxy functionality | 埃克森美孚化学专利公司 | 2022-07-15 | — | — | CN | disclosed |