⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5200898 | 0.78 | — | — | |
| SCHEMBL6386489 | 0.76 | GAA (0.36) | — | |
| SCHEMBL5201388 | 0.72 | GAA (0.36) | — | |
| SCHEMBL12303057 | 0.72 | GAA (0.50) | — | |
| SCHEMBL5199655 | 0.70 | CCNT1 (0.33) | — | |
| SCHEMBL3842244 | 0.69 | MAPT (0.61) | — | |
| SCHEMBL3839571 | 0.69 | CCNE1 (0.55) | — | |
| SCHEMBL15202553 | 0.68 | — | — | |
| SCHEMBL12251526 | 0.67 | GAA (0.50) | — | |
| SCHEMBL3856559 | 0.65 | GAA (0.44) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7985288-B2 | Colorant compound and ink including the colorant compound | CANON KABUSHIKI KAISHA (JP) | 2011-07-26 | — | — | US | disclosed |
| US-20100089285-A1 | COLORANT COMPOUND AND INK INCLUDING THE COLORANT COMPOUND | CANON KABUSHIKI KAISHA (JP) | 2010-04-15 | — | — | US | disclosed |