⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23333379 | 0.98 | — | — | |
| SCHEMBL23333777 | 0.95 | — | — | |
| SCHEMBL22780279 | 0.94 | — | — | |
| SCHEMBL23333530 | 0.93 | — | — | |
| SCHEMBL22779991 | 0.91 | — | — | |
| SCHEMBL23334181 | 0.90 | — | — | |
| SCHEMBL22787909 | 0.90 | — | — | |
| SCHEMBL23614545 | 0.90 | — | — | |
| SCHEMBL22791246 | 0.90 | SLC6A2 (0.30) | — | |
| SCHEMBL23333509 | 0.89 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210130295-A1 | COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME | LG CHEM, LTD. (KR) | 2021-05-06 | — | — | US | disclosed |