⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8070578 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL9853283 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL29373410 | 0.67 | — | — | |
| SCHEMBL9853224 | 0.66 | ALDH1A1 (0.32) | — | |
| SCHEMBL17444459 | 0.65 | — | — | |
| SCHEMBL8073748 | 0.63 | — | — | |
| SCHEMBL14797721 | 0.63 | MGLL (0.30) | — | |
| SCHEMBL14797528 | 0.63 | MGLL (0.30) | — | |
| SCHEMBL31722352 | 0.63 | — | — | |
| SCHEMBL8059599 | 0.62 | — | — |
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-6165930-A | Organosilane compounds | MONTELL NORTH AMERICA INC. (US) | 2000-12-26 | — | — | US | disclosed |
| EP-0410443-B1 | Organosilane compounds | HIMONT INC (US) | 1995-01-11 | — | — | EP | disclosed |
| US-5166340-A | Polymerization catalysts, coordination catalysts for olefin polymerization | HIMONT INCORPORATED (US) | 1992-11-24 | — | — | US | disclosed |
| EP-0410443-A1 | Organosilane compounds | MONTELL NORTH AMERICA INC. (US) | 1991-01-30 | — | — | EP | disclosed |