⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL28402862 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL11595001 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL57962 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL1819083 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL11305571 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL9188372 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL1588456 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL11244790 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL5497180 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL6049906 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0418972-A1 | Strontium and/or barium-containing catalysts for oxidative coupling processes | UNION CARBIDE CHEMICALS AND PLASTICS COMPANY, INC. (US) | 1991-03-27 | — | — | EP | claimed |
| US-4340524-A | HYDROPHOBIC RESINS AND HYDROLYZABLE AMINOSILANES | UNION CARBIDE CORPORATION (US) | 1982-07-20 | — | — | US | disclosed |