⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18173492 | 0.70 | — | — | |
| SCHEMBL8079423 | 0.69 | — | — | |
| SCHEMBL9550900 | 0.61 | — | — | |
| SCHEMBL28905975 | 0.61 | — | — | |
| SCHEMBL31054194 | 0.60 | — | — | |
| SCHEMBL31151773 | 0.60 | — | — | |
| SCHEMBL2689541 | 0.56 | — | — | |
| SCHEMBL9350367 | 0.55 | — | — | |
| SCHEMBL1101110 | 0.55 | — | — | |
| SCHEMBL2353398 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0841340-B1 | SUBSTITUTED BENZENEDITHIOL-METAL COMPLEXES | SUMITOMO SEIKA CHEMICALS (JP) | 2002-06-19 | — | — | EP | claimed |