⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7112110 | 0.82 | — | — | |
| SCHEMBL248349 | 0.82 | — | — | |
| SCHEMBL3703824 | 0.71 | — | — | |
| SCHEMBL31172872 | 0.64 | — | — | |
| SCHEMBL11165352 | 0.64 | — | — | |
| SCHEMBL10525209 | 0.58 | — | — | |
| SCHEMBL8442506 | 0.58 | — | — | |
| SCHEMBL574380 | 0.58 | — | — | |
| SCHEMBL6337 | 0.58 | — | — | |
| SCHEMBL3000070 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117777332-A | Electron transport material containing photoswitchable ionized polymer and application of electron transport material in photoswitchable organic electroluminescent display device | 上海交通大学 | 2024-03-29 | — | — | CN | disclosed |