⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25252721 | 1.00 | — | — | |
| SCHEMBL25297601 | 0.97 | — | — | |
| SCHEMBL25297514 | 0.90 | — | — | |
| SCHEMBL25251692 | 0.82 | — | — | |
| SCHEMBL1961947 | 0.71 | — | — | |
| SCHEMBL14575124 | 0.69 | — | — | |
| SCHEMBL548297 | 0.69 | — | — | |
| SCHEMBL9319044 | 0.69 | — | — | |
| SCHEMBL11324609 | 0.69 | — | — | |
| SCHEMBL487409 | 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-20230311554-A1 | Thermosensitive Recording Material | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2023-10-05 | — | — | US | disclosed |
| EP-4205990-A1 | THERMOSENSITIVE RECORDING MATERIAL | Nippon Kayaku Kabushiki Kaisha (JP) | 2023-07-05 | — | — | EP | disclosed |