⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15636683 | 0.67 | — | — | |
| SCHEMBL2029122 | 0.63 | — | — | |
| SCHEMBL2037917 | 0.63 | — | — | |
| SCHEMBL2038552 | 0.61 | — | — | |
| SCHEMBL2037026 | 0.61 | — | — | |
| SCHEMBL19484836 | 0.59 | — | — | |
| SCHEMBL8898232 | 0.57 | TSHR (0.33) | — | |
| SCHEMBL31264959 | 0.47 | — | — | |
| Butane SCHEMBL1734106 | 0.43 | — | — | |
| Butane SCHEMBL9292387 | 0.43 | TSHR (0.50) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4232504-A1 | POLYCARBOSILAZANE, AND COMPOSITION COMPRISING THE SAME, AND METHOD FOR PRODUCING SILICON-CONTAINING FILM USING THE SAME | Merck Patent GmbH (DE) | 2023-08-30 | — | — | EP | disclosed |
| CN-116547356-A | Polycarbosilazane, composition containing same, and method for producing silicon-containing film using same | 默克专利有限公司 | 2023-08-04 | — | — | CN | disclosed |
| WO-2022084022-A1 | POLYCARBOSILAZANE, AND COMPOSITION COMPRISING THE SAME, AND METHOD FOR PRODUCING SILICON-CONTAINING FILM USING THE SAME | MERCK PATENT GMBH (DE) | 2022-04-28 | — | — | WO | disclosed |