⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11251864 | 0.81 | ALDH1A1 (0.30) | — | |
| SCHEMBL4454386 | 0.77 | — | — | |
| SCHEMBL2386240 | 0.77 | — | — | |
| SCHEMBL2386236 | 0.77 | — | — | |
| SCHEMBL6740642 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL9548483 | 0.75 | — | — | |
| SCHEMBL28100447 | 0.72 | — | — | |
| SCHEMBL28672343 | 0.72 | DNM1 (0.35) | — | |
| SCHEMBL11252148 | 0.72 | — | — | |
| SCHEMBL2767399 | 0.71 | MAPK1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4342681-A | Use of organic silicon compounds in combination with oxetane compounds, dioxanes or tetrahydrofuranes for stabilizing and brightening polycarbonates which are free from phosphites and free from boric acid esters | BAYER AKTIENGESELLSCHAFT (DE) | 1982-08-03 | — | — | US | disclosed |