⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3243312 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL8715781 | 0.96 | — | — | |
| SCHEMBL6151601 | 0.94 | — | — | |
| SCHEMBL6910589 | 0.77 | — | — | |
| SCHEMBL27432568 | 0.75 | ACHE (0.33) | — | |
| Hydrochloric Acid SCHEMBL6908443 | 0.71 | — | — | |
| SCHEMBL8714826 | 0.71 | TP53 (0.32) | — | |
| Biphenyl SCHEMBL8162884 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL9004769 | 0.68 | HSD11B1 (0.31) | — | |
| SCHEMBL7520963 | 0.68 | TP53 (0.33) | — |
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-0669346-B1 | Solid catalyst components for olefin polymerization and use thereof | NIPPON OIL CO LTD (JP) | 1998-06-03 | — | — | EP | disclosed |
| EP-0669346-A1 | Solid catalyst components for olefin polymerization and use thereof | NIPPON OIL CO. LTD. (JP) | 1995-08-30 | — | — | EP | disclosed |