⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24907892 | 0.97 | — | — | |
| SCHEMBL24047897 | 0.94 | CYP1A1 (0.31) | — | |
| SCHEMBL24047505 | 0.94 | CYP1A1 (0.31) | — | |
| SCHEMBL24047944 | 0.93 | — | — | |
| SCHEMBL24047781 | 0.92 | GAA (0.32) | — | |
| SCHEMBL24907668 | 0.92 | GAA (0.32) | — | |
| SCHEMBL24907931 | 0.92 | KDM4E (0.30) | — | |
| SCHEMBL24908010 | 0.92 | — | — | |
| SCHEMBL24907874 | 0.91 | ANO1 (0.30) | — | |
| SCHEMBL24048085 | 0.90 | CYP1A1 (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-2023003436-A1 | ORGANIC LIGHT-EMITTING DEVICE | 주식회사 엘지화학 | 2023-01-26 | — | — | WO | disclosed |