⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4969702 | 0.72 | — | — | |
| SCHEMBL330158 | 0.72 | — | — | |
| SCHEMBL5250 | 0.72 | — | — | |
| SCHEMBL2956483 | 0.67 | — | — | |
| Potassium SCHEMBL1581738 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL8031293 | 0.67 | — | — | |
| SCHEMBL4732383 | 0.67 | — | — | |
| Bromide SCHEMBL20500128 | 0.67 | — | — | |
| SCHEMBL1525899 | 0.67 | — | — | |
| SCHEMBL2755195 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5380791-A | Method of producing sulfonated organosilicon compounds and coresponding aqueous solutions | DEGUSSA AKTIENGESELLSCHAFT (DE) | 1995-01-10 | — | — | US | disclosed |
| US-4814471-A | Process for preparing sulphonated organosilicon compounds | DOW CORNING, LTD. (GB) | 1989-03-21 | — | — | US | disclosed |
| US-4777277-A | Organosilicon sulphosuccinates | DOW CORNING, LTD. (GB) | 1988-10-11 | — | — | US | disclosed |
| EP-0283156-A2 | Organosilicon sulphosuccinates | Dow Corning Limited (GB) | 1988-09-21 | — | — | EP | disclosed |