⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13859934 | 0.81 | — | — | |
| Ammonia Solution, Strong SCHEMBL4318267 | 0.77 | — | — | |
| SCHEMBL4313477 | 0.75 | — | — | |
| SCHEMBL13859774 | 0.75 | — | — | |
| SCHEMBL13859883 | 0.73 | — | — | |
| SCHEMBL13859882 | 0.73 | — | — | |
| Sulfuric Acid SCHEMBL4318273 | 0.72 | — | — | |
| Sulfuric Acid SCHEMBL4318280 | 0.72 | — | — | |
| SCHEMBL4328903 | 0.69 | — | — | |
| SCHEMBL4323135 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007016359-A2 | PRODUCTION PROCESSES AND SYSTEMS, COMPOSITIONS, SURFACTANTS, MONOMER UNITS, METAL COMPLEXES, PHOSPHATE ESTERS, GLYCOLS, AQUEOUS FILM FORMING FOAMS, AND FOAM STABILIZERS | GREAT LAKES CHEMICAL CORPORATION (US) | 2007-02-08 | — | — | WO | disclosed |