⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24889738 | 0.92 | ALOX5 (0.32) | — | |
| SCHEMBL24230856 | 0.91 | ALOX5 (0.33) | — | |
| SCHEMBL24886980 | 0.91 | ALOX5 (0.32) | — | |
| SCHEMBL24973455 | 0.91 | GPR84 (0.31) | — | |
| SCHEMBL24888792 | 0.89 | PRKDC (0.33) | — | |
| SCHEMBL24890118 | 0.87 | PRKDC (0.33) | — | |
| SCHEMBL24889855 | 0.86 | ALOX5 (0.33) | — | |
| SCHEMBL24889189 | 0.86 | — | — | |
| SCHEMBL24907595 | 0.85 | PRKDC (0.33) | — | |
| SCHEMBL24886427 | 0.85 | PRKDC (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-2023287228-A1 | ORGANIC LIGHT EMITTING DEVICE | 주식회사 엘지화학 | 2023-01-19 | — | — | WO | disclosed |