⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21159919 | 0.89 | — | — | |
| SCHEMBL22056872 | 0.84 | P2RX7 (0.30) | — | |
| SCHEMBL22056433 | 0.82 | F11 (0.30) | — | |
| SCHEMBL22056958 | 0.81 | — | — | |
| SCHEMBL18819311 | 0.80 | — | — | |
| SCHEMBL21159908 | 0.79 | MAPT (0.41) | — | |
| SCHEMBL22056957 | 0.79 | — | — | |
| SCHEMBL18819238 | 0.78 | P2RX7 (0.33) | — | |
| SCHEMBL21160300 | 0.77 | — | — | |
| SCHEMBL18819549 | 0.77 | P2RX7 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3498804-B1 | ORGANIC LIGHT EMITTING DEVICE | LG CHEMICAL LTD (KR) | 2020-06-03 | — | — | EP | disclosed |