⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22936016 | 0.90 | — | — | |
| SCHEMBL24772180 | 0.84 | AHR (0.30) | — | |
| SCHEMBL22937984 | 0.84 | POLB (0.30) | — | |
| SCHEMBL26306926 | 0.84 | RARB (0.34) | — | |
| SCHEMBL26307474 | 0.84 | RARB (0.37) | — | |
| SCHEMBL29331329 | 0.84 | RARB (0.37) | — | |
| SCHEMBL26303502 | 0.84 | RARB (0.37) | — | |
| SCHEMBL23439512 | 0.82 | — | — | |
| SCHEMBL22934109 | 0.80 | RXRA (0.39) | — | |
| SCHEMBL22936267 | 0.79 | MEN1 (0.32) | — |
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-2021020931-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME | 주식회사 엘지화학 | 2021-02-04 | — | — | WO | disclosed |