⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL249890 | 0.90 | OPRM1 (0.30) | — | |
| SCHEMBL4608627 | 0.88 | LMNA (0.31) | — | |
| SCHEMBL4464656 | 0.85 | LMNA (0.32) | — | |
| Alcohol SCHEMBL28511714 | 0.85 | — | — | |
| Isopropylamine SCHEMBL28374463 | 0.79 | OPRM1 (0.33) | — | |
| SCHEMBL18240047 | 0.79 | OPRM1 (0.33) | — | |
| SCHEMBL2034096 | 0.79 | LMNA (0.34) | — | |
| SCHEMBL1609567 | 0.79 | LMNA (0.34) | — | |
| SCHEMBL5049085 | 0.78 | OPRM1 (0.37) | — | |
| SCHEMBL1050535 | 0.77 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7592042-B1 | reducing agent with reverse micelle solutions including metal salt at low temperature, coating core component with shell component by adding reverse micelle solution containing hydrolysate and/or partial condensate of polysiloxane or titanium-hydroxide containing compounds | FUJIFILM CORPORATION (JP) | 2009-09-22 | — | — | US | disclosed |
| US-20090232992-A1 | reducing agent with reverse micelle solutions including metal salt at low temperature, coating core component with shell component by adding reverse micelle solution containing hydrolysate and/or partial condensate of polysiloxane or titanium-hydroxide containing compounds | FUJIFILM CORPORATION (JP) | 2009-09-17 | — | — | US | disclosed |