⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26950294 | 0.94 | KDM4E (0.33) | — | |
| SCHEMBL26946552 | 0.91 | — | — | |
| SCHEMBL26952058 | 0.90 | RXRA (0.32) | — | |
| SCHEMBL26951697 | 0.89 | RXRA (0.32) | — | |
| SCHEMBL26951633 | 0.88 | — | — | |
| SCHEMBL26952105 | 0.87 | RXRA (0.33) | — | |
| SCHEMBL26951222 | 0.86 | — | — | |
| SCHEMBL26952060 | 0.86 | RXRA (0.32) | — | |
| SCHEMBL26951454 | 0.86 | RXRA (0.34) | — | |
| SCHEMBL26950756 | 0.85 | KDM4E (0.33) | — |
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-2023239092-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-12-14 | — | — | WO | disclosed |