⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23445146 | 0.81 | RXRA (0.33) | — | |
| SCHEMBL23447257 | 0.81 | RXRA (0.34) | — | |
| SCHEMBL24084591 | 0.80 | — | — | |
| SCHEMBL23445015 | 0.71 | RXRA (0.33) | — | |
| SCHEMBL23445662 | 0.69 | RXRA (0.32) | — | |
| SCHEMBL23445020 | 0.69 | RXRA (0.34) | — | |
| SCHEMBL23446005 | 0.68 | RXRA (0.34) | — | |
| SCHEMBL26404753 | 0.67 | RARB (0.37) | — | |
| SCHEMBL23442800 | 0.66 | RARB (0.46) | — | |
| SCHEMBL29945232 | 0.66 | RARB (0.46) | — |
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-3919500-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LG CHEM, LTD. (KR) | 2021-12-08 | — | — | EP | disclosed |