⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL374755 | 0.73 | — | — | |
| SCHEMBL30736054 | 0.73 | — | — | |
| SCHEMBL16878159 | 0.68 | — | — | |
| SCHEMBL3930826 | 0.67 | — | — | |
| SCHEMBL3934420 | 0.67 | — | — | |
| SCHEMBL374489 | 0.67 | EGFR (0.37) | — | |
| SCHEMBL30148832 | 0.67 | EGFR (0.37) | — | |
| SCHEMBL29464263 | 0.66 | PIK3CG (0.38) | — | |
| SCHEMBL3939892 | 0.64 | — | — | |
| SCHEMBL3933600 | 0.62 | — | — |
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-115244723-A | Organic electroluminescent device | 默克专利有限公司 | 2022-10-25 | — | — | CN | disclosed |