⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10748790 | 0.75 | — | — | |
| SCHEMBL9797526 | 0.73 | MEN1 (0.30) | — | |
| SCHEMBL3263837 | 0.66 | — | — | |
| SCHEMBL793258 | 0.63 | — | — | |
| SCHEMBL222968 | 0.63 | — | — | |
| Oxirane SCHEMBL7156599 | 0.63 | MEN1 (0.31) | — | |
| SCHEMBL252753 | 0.61 | — | — | |
| SCHEMBL18006567 | 0.61 | ALDH1A1 (0.32) | — | |
| SCHEMBL1965552 | 0.61 | — | — | |
| SCHEMBL9504382 | 0.61 | — | — |
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 |