⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16050057 | 0.92 | — | — | |
| Tetramethylammonium Ion SCHEMBL23162524 | 0.82 | — | — | |
| SCHEMBL38655461 | 0.67 | — | — | |
| SCHEMBL1271269 | 0.66 | — | — | |
| Perflisobutane SCHEMBL397750 | 0.66 | — | — | |
| Potassium Ion SCHEMBL9418916 | 0.64 | — | — | |
| SCHEMBL5040262 | 0.64 | — | — | |
| SCHEMBL6280400 | 0.61 | — | — | |
| SCHEMBL5539831 | 0.61 | — | — | |
| Potassium Ion SCHEMBL10969351 | 0.58 | LMNA (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1982972-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND | Sumitomo Chemical Company, Limited (JP) | 2008-10-22 | — | — | EP | disclosed |
| EP-1982973-A1 | METHOD FOR PRODUCING OPTICALLY ACTIVE ALCOHOL COMPOUND | Sumitomo Chemical Company, Limited (JP) | 2008-10-22 | — | — | EP | disclosed |