⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13762169 | 1.00 | — | — | |
| SCHEMBL642477 | 0.72 | — | — | |
| SCHEMBL640792 | 0.72 | — | — | |
| SCHEMBL640791 | 0.72 | — | — | |
| SCHEMBL5028673 | 0.70 | — | — | |
| SCHEMBL18074135 | 0.59 | — | — | |
| SCHEMBL18074131 | 0.59 | — | — | |
| SCHEMBL24584129 | 0.56 | — | — | |
| SCHEMBL4756184 | 0.56 | — | — | |
| SCHEMBL11892837 | 0.56 | — | — |
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-1477488-B1 | NOVEL OPTICALLY ACTIVE COMPOUNDS, METHOD FOR KINETIC OPTICAL RESOLUTION OF CARBOXYLIC ACID DERIVATIVES AND CATALYSTS THEREFOR | DAISO CO LTD (JP) | 2009-08-26 | — | — | EP | disclosed |