⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL34408 | 0.76 | — | — | |
| SCHEMBL3299268 | 0.76 | — | — | |
| SCHEMBL2166444 | 0.68 | — | — | |
| SCHEMBL11467330 | 0.68 | — | — | |
| SCHEMBL2421101 | 0.68 | — | — | |
| Water SCHEMBL23631872 | 0.68 | — | — | |
| Bromide SCHEMBL11162750 | 0.68 | — | — | |
| Water SCHEMBL25332890 | 0.68 | — | — | |
| SCHEMBL23275586 | 0.68 | — | — | |
| Water SCHEMBL10945199 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100430239-C | Thermosensitive recording medium | JUJO PAPER CO LTD (JP) | 2008-11-05 | — | — | CN | disclosed |
| CN-1729106-A | Heat-sensitive recording medium | JUJO PAPER CO LTD (JP) | 2006-02-01 | — | — | CN | disclosed |