⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5479496 | 0.73 | — | — | |
| SCHEMBL7937442 | 0.70 | — | — | |
| SCHEMBL19425718 | 0.69 | — | — | |
| SCHEMBL17427767 | 0.69 | TDP1 (0.35) | — | |
| SCHEMBL27678522 | 0.69 | — | — | |
| SCHEMBL27678517 | 0.69 | — | — | |
| SCHEMBL27697364 | 0.69 | — | — | |
| SCHEMBL12804954 | 0.69 | — | — | |
| SCHEMBL27574492 | 0.65 | — | — | |
| SCHEMBL11347633 | 0.63 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102597065-B | Process for preparing clustered functional polyorganosiloxanes, and methods for their use | DOW CORNING | 2015-07-22 | — | — | CN | disclosed |
| CN-102977262-A | Amino oxide group-containing resin solution and resin composition for hair cosmetics using the same | MITSUBISHI CHEM CORP | 2013-03-20 | — | — | CN | disclosed |
| CN-102766009-A | Sulfonated phenols with nitrophenols as polymerization inhibitors | CHEMTURA CORP | 2012-11-07 | — | — | CN | disclosed |
| CN-101827874-A | Amino oxide group-containing resin solution and resin composition for hair cosmetics using the same | MITSUBISHI CHEM CORP | 2010-09-08 | — | — | CN | disclosed |
| CN-100564332-C | Sulfonated nitrophenols as polymerization inhibitors | CHEMTURA CORP (US) | 2009-12-02 | — | — | CN | disclosed |
| CN-101044106-A | Sulfonated phenols and nitrophenols as polymerization inhibitors | CHEMTURA CORP (US) | 2007-09-26 | — | — | CN | disclosed |
| CN-101031528-A | Sulfonated nitrophenols as polymerization inhibitors | CHEMTURA CORP (US) | 2007-09-05 | — | — | CN | disclosed |