⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6547725 | 0.83 | — | — | |
| SCHEMBL8021127 | 0.83 | — | — | |
| SCHEMBL6550040 | 0.82 | S1PR2 (0.30) | — | |
| SCHEMBL8024725 | 0.79 | — | — | |
| SCHEMBL8011683 | 0.74 | ESR1 (0.32) | — | |
| SCHEMBL8027541 | 0.71 | — | — | |
| SCHEMBL8024215 | 0.70 | — | — | |
| SCHEMBL8027736 | 0.70 | CES2 (0.36) | — | |
| SCHEMBL8025871 | 0.70 | — | — | |
| SCHEMBL8011657 | 0.69 | LMNA (0.31) | — |
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-0975586-A2 | OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION | Sumitomo Chemical Company, Limited (JP) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998045254-A2 | OXIME COMPOUNDS, THEIR USE, AND INTERMEDIATES FOR THEIR PRODUCTION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-10-15 | — | — | WO | disclosed |