⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19916171 | 0.92 | — | — | |
| SCHEMBL20031101 | 0.90 | — | — | |
| SCHEMBL18714897 | 0.90 | — | — | |
| SCHEMBL19441057 | 0.90 | — | — | |
| SCHEMBL20828535 | 0.90 | — | — | |
| SCHEMBL19175974 | 0.86 | — | — | |
| SCHEMBL20118000 | 0.85 | — | — | |
| SCHEMBL18744662 | 0.78 | — | — | |
| SCHEMBL21423381 | 0.78 | — | — | |
| SCHEMBL15197917 | 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 |
|---|---|---|---|---|---|---|---|
| EP-1777273-A1 | Ink composition, ink set and recording method | Fujifilm Corporation (JP) | 2007-04-25 | — | — | EP | disclosed |