⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6277019 | 0.84 | — | — | |
| SCHEMBL6280483 | 0.78 | CHRNB2 (0.30) | — | |
| SCHEMBL7003017 | 0.75 | — | — | |
| SCHEMBL6284245 | 0.67 | — | — | |
| SCHEMBL7197512 | 0.64 | KDM1A (0.32) | — | |
| SCHEMBL14931913 | 0.64 | — | — | |
| SCHEMBL890426 | 0.63 | KDM1A (0.35) | — | |
| Boric Acid SCHEMBL217449 | 0.61 | LMNA (0.33) | — | |
| Boric Acid SCHEMBL5074757 | 0.61 | LMNA (0.33) | — | |
| Boric Acid SCHEMBL6277854 | 0.61 | LMNA (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1296991-B1 | SILOXY SUBSTITUTED COCATALYST ACTIVATORS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEM PATENTS INC (US) | 2013-05-15 | — | — | EP | disclosed |