⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13407451 | 0.87 | CA12 (0.35) | — | |
| SCHEMBL13778044 | 0.81 | — | — | |
| SCHEMBL13324846 | 0.75 | — | — | |
| SCHEMBL13614661 | 0.73 | — | — | |
| SCHEMBL24805949 | 0.72 | — | — | |
| SCHEMBL13360890 | 0.72 | — | — | |
| SCHEMBL13236849 | 0.72 | — | — | |
| SCHEMBL13596360 | 0.72 | — | — | |
| SCHEMBL15757922 | 0.71 | — | — | |
| SCHEMBL10005659 | 0.69 | — | — |
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-7709547-B2 | Ink composition, inkjet recording method, printed material, production method of a planographic printing plate and planographic printing plate | FUJIFILM CORPORATION (JP) | 2010-05-04 | — | — | US | disclosed |
| US-20070115326-A1 | Ink composition, inkjet recording method, printed material, production method of a planographic printing plate and planographic printing plate | FUJIFILM CORPORATION | 2007-05-24 | — | — | US | disclosed |