⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31483563 | 0.80 | — | — | |
| SCHEMBL28814404 | 0.75 | USP2 (0.30) | — | |
| SCHEMBL4912537 | 0.70 | — | — | |
| SCHEMBL1560557 | 0.69 | — | — | |
| SCHEMBL31254875 | 0.67 | — | — | |
| SCHEMBL21316482 | 0.62 | — | — | |
| SCHEMBL3282371 | 0.60 | ALDH1A1 (0.44) | — | |
| SCHEMBL6200154 | 0.60 | LMNA (0.34) | — | |
| SCHEMBL31393663 | 0.59 | — | — | |
| SCHEMBL30503567 | 0.58 | CCR1 (0.47) | — |
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-115433237-A | Organometallic compound, light-emitting device including the same, and electronic apparatus | 三星显示有限公司 | 2022-12-06 | — | — | CN | disclosed |