⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5944467 | 0.82 | — | — | |
| SCHEMBL5944499 | 0.81 | — | — | |
| SCHEMBL422565 | 0.80 | PIK3CD (0.30) | — | |
| SCHEMBL13714479 | 0.79 | — | — | |
| Bromide SCHEMBL27709045 | 0.78 | — | — | |
| Iodide SCHEMBL4277559 | 0.78 | — | — | |
| SCHEMBL5944563 | 0.78 | — | — | |
| SCHEMBL2523815 | 0.78 | SLC18A3 (0.33) | — | |
| SCHEMBL2527713 | 0.77 | — | — | |
| SCHEMBL28187708 | 0.77 | — | — |
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 |