⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL226240 | 0.76 | ALDH1A1 (0.41) | — | |
| SCHEMBL723231 | 0.73 | — | — | |
| SCHEMBL7889951 | 0.71 | ESR1 (0.35) | — | |
| SCHEMBL2141368 | 0.69 | ESR1 (0.43) | — | |
| SCHEMBL5026169 | 0.67 | — | — | |
| SCHEMBL6054017 | 0.63 | — | — | |
| SCHEMBL127652 | 0.63 | — | — | |
| SCHEMBL1674781 | 0.62 | ALDH1A1 (0.41) | — | |
| SCHEMBL160241 | 0.62 | ALDH1A1 (0.41) | — | |
| SCHEMBL8040579 | 0.61 | ESR1 (0.43) | — |
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-0057018-B1 | PHOTO-CURABLE EPOXY RESIN COMPOSITION | KABUSHIKI KAISHA TOSHIBA (JP) | 1985-06-05 | — | — | EP | disclosed |
| EP-0057018-A2 | Photo-curable epoxy resin composition | KABUSHIKI KAISHA TOSHIBA (JP) | 1982-08-04 | — | — | EP | disclosed |