⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2235309 | 0.98 | — | — | |
| SCHEMBL2233339 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL2232791 | 0.88 | — | — | |
| Fluoride SCHEMBL2233822 | 0.88 | — | — | |
| Methyl Alcohol SCHEMBL1079599 | 0.87 | — | — | |
| SCHEMBL2234013 | 0.85 | — | — | |
| SCHEMBL27808706 | 0.79 | — | — | |
| SCHEMBL2232721 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL2232892 | 0.69 | — | — | |
| SCHEMBL19581429 | 0.69 | SKP2 (0.30) | — |
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-1799726-B1 | TRIALKYLALUMINUM TREATED SUPPORTS | EXXONMOBIL CHEM PATENTS INC (US) | 2011-07-13 | — | — | EP | claimed |