⚠ 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 | |
|---|---|---|---|---|
| Nitrogen SCHEMBL8587239 | 0.87 | — | — | |
| Nitrogen SCHEMBL9803700 | 0.87 | — | — | |
| Nitrogen SCHEMBL9614346 | 0.82 | — | — | |
| Nitrogen SCHEMBL38 | 0.82 | — | — | |
| Nitrogen SCHEMBL175740 | 0.82 | — | — | |
| Nitrogen SCHEMBL6395401 | 0.82 | — | — | |
| SCHEMBL4623947 | 0.82 | — | — | |
| Nitrogen SCHEMBL692938 | 0.67 | — | — | |
| Nitrogen SCHEMBL1251397 | 0.67 | — | — | |
| Nitrogen SCHEMBL253623 | 0.67 | — | — |
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-1047607-C | Water-soluble fluorescent dye | UNIV DALIAN SCIENCE & ENG (CN) | 1999-12-22 | — | — | CN | disclosed |
| CN-1125743-A | Water-soluble fluorescent dye | DALIAN POLYTECHNICAL UNIV (CN) | 1996-07-03 | — | — | CN | disclosed |