⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29145076 | 1.00 | — | — | |
| SCHEMBL2260380 | 1.00 | — | — | |
| SCHEMBL1352987 | 0.82 | — | — | |
| SCHEMBL2885847 | 0.82 | — | — | |
| SCHEMBL1696952 | 0.82 | — | — | |
| SCHEMBL94141 | 0.82 | — | — | |
| SCHEMBL2126237 | 0.82 | — | — | |
| SCHEMBL1560733 | 0.82 | — | — | |
| SCHEMBL10953831 | 0.82 | — | — | |
| SCHEMBL2262756 | 0.82 | — | — |
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-5078987-A | Iodine complexed with polyvinylpyrrolidone in a plastic container, storage stability | SUNSTAR K.K. (JP) | 1992-01-07 | — | — | US | disclosed |