⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26951698 | 0.91 | — | — | |
| SCHEMBL26946915 | 0.91 | RXRA (0.32) | — | |
| SCHEMBL26946924 | 0.90 | RXRA (0.31) | — | |
| SCHEMBL26946551 | 0.89 | RXRA (0.33) | — | |
| SCHEMBL26946452 | 0.88 | — | — | |
| SCHEMBL26946918 | 0.88 | RXRA (0.32) | — | |
| SCHEMBL26946982 | 0.88 | RXRA (0.33) | — | |
| SCHEMBL26950294 | 0.88 | KDM4E (0.33) | — | |
| SCHEMBL26946919 | 0.87 | RXRA (0.34) | — | |
| SCHEMBL26945827 | 0.86 | — | — |
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-2023239091-A1 | NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2023-12-14 | — | — | WO | disclosed |