⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23078267 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL24902353 | 0.76 | — | — | |
| SCHEMBL27254134 | 0.70 | KDM4E (0.31) | — | |
| SCHEMBL26788555 | 0.68 | KDM4E (0.33) | — | |
| SCHEMBL19544820 | 0.67 | HDAC8 (0.35) | — | |
| SCHEMBL20009931 | 0.65 | CYP11B1 (0.37) | — | |
| SCHEMBL24903066 | 0.65 | CYP11B1 (0.37) | — | |
| SCHEMBL19544819 | 0.65 | CYP2C9 (0.39) | — | |
| SCHEMBL26318446 | 0.65 | KDM4E (0.41) | — | |
| SCHEMBL24903191 | 0.64 | KDM4E (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4223743-A1 | COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE | Idemitsu Kosan Co.,Ltd. (JP) | 2023-08-09 | — | — | EP | disclosed |