⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5944695 | 0.85 | — | — | |
| SCHEMBL5944415 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL3458706 | 0.80 | — | — | |
| SCHEMBL4281315 | 0.80 | LPAR3 (0.36) | — | |
| SCHEMBL5297696 | 0.79 | — | — | |
| SCHEMBL486704 | 0.74 | — | — | |
| SCHEMBL5296956 | 0.74 | — | — | |
| SCHEMBL5817012 | 0.73 | ALDH1A1 (0.32) | — | |
| SCHEMBL5304211 | 0.73 | ALDH1A1 (0.32) | — | |
| SCHEMBL5286352 | 0.73 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| US-20060186419-A1 | Light-emitting device | KABUSHIKI KAISHA TOSHIBA (JP) | 2006-08-24 | — | — | US | disclosed |