⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4373290 | 0.79 | — | — | |
| SCHEMBL5827456 | 0.76 | CA2 (0.32) | — | |
| SCHEMBL861862 | 0.73 | — | — | |
| SCHEMBL14079437 | 0.72 | CA2 (0.30) | — | |
| SCHEMBL1654683 | 0.71 | LMNA (0.36) | — | |
| SCHEMBL8553557 | 0.70 | — | — | |
| SCHEMBL18709887 | 0.70 | — | — | |
| SCHEMBL6223633 | 0.69 | — | — | |
| SCHEMBL505953 | 0.69 | — | — | |
| SCHEMBL7893094 | 0.68 | — | — |
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-20240018376-A1 | AQUEOUS ADDITIVE SOLUTION FOR INK COMPOSITION, AQUEOUS COLORANT SOLUTION FOR INK COMPOSITION, INK COMPOSITION, INK COMPOSITION FOR INK JET RECORDING, AND INK JET RECORDING METHOD | FUJIFILM CORPORATION (JP) | 2024-01-18 | — | — | US | disclosed |