⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23445009 | 0.96 | — | — | |
| SCHEMBL25104185 | 0.84 | — | — | |
| SCHEMBL23442563 | 0.81 | RXRA (0.31) | — | |
| SCHEMBL26498345 | 0.80 | — | — | |
| SCHEMBL23442546 | 0.80 | SCD (0.32) | — | |
| SCHEMBL25102878 | 0.79 | — | — | |
| SCHEMBL23445607 | 0.77 | RXRA (0.30) | — | |
| SCHEMBL25952727 | 0.71 | RARA (0.31) | — | |
| SCHEMBL24217469 | 0.71 | — | — | |
| SCHEMBL23450940 | 0.71 | RARA (0.31) | — |
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-2021107681-A1 | COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2021-06-03 | — | — | WO | disclosed |