⚠ 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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL79426 | 1.00 | — | — | |
| Ethylene SCHEMBL6282694 | 0.87 | — | — | |
| Ethylene SCHEMBL20704916 | 0.87 | — | — | |
| Ethylene SCHEMBL2142051 | 0.87 | — | — | |
| Ethylene SCHEMBL675055 | 0.82 | — | — | |
| Ethylene SCHEMBL9863791 | 0.82 | — | — | |
| Ethylene SCHEMBL7596303 | 0.82 | — | — | |
| Ethylene SCHEMBL8323678 | 0.82 | — | — | |
| Ethylene SCHEMBL1331580 | 0.82 | — | — | |
| Ethylene SCHEMBL1332643 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5089454-A | Magnesium oxide porous carrier impregnated with palladium or platinum and potassium, cesium or barium chloride or fluoride | SOLVAY & CIE (SOCIETE ANONYME) (BE) | 1992-02-18 | — | — | US | disclosed |