⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13753689 | 0.91 | — | — | |
| SCHEMBL19311765 | 0.89 | KDM4E (0.34) | — | |
| SCHEMBL24488501 | 0.89 | CA12 (0.32) | — | |
| SCHEMBL20714496 | 0.87 | KDM4E (0.39) | — | |
| SCHEMBL14051959 | 0.87 | — | — | |
| SCHEMBL17384138 | 0.87 | L3MBTL1 (0.34) | — | |
| SCHEMBL24971551 | 0.85 | — | — | |
| SCHEMBL23784481 | 0.85 | KDM4E (0.39) | — | |
| SCHEMBL23784507 | 0.85 | KDM4E (0.33) | — | |
| SCHEMBL13003016 | 0.85 | KDM4E (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023171769-A1 | COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | 出光興産株式会社 | 2023-09-14 | — | — | WO | disclosed |