⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1300378 | 0.78 | — | — | |
| SCHEMBL8942894 | 0.78 | — | — | |
| SCHEMBL13827000 | 0.76 | — | — | |
| SCHEMBL22587457 | 0.76 | — | — | |
| SCHEMBL2633900 | 0.76 | — | — | |
| SCHEMBL26922 | 0.76 | — | — | |
| SCHEMBL2634001 | 0.76 | — | — | |
| SCHEMBL3052642 | 0.76 | — | — | |
| SCHEMBL1076296 | 0.76 | — | — | |
| SCHEMBL6622386 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20170333887-A1 | CATALYSTS FOR METATHESIS REACTIONS INCLUDING ENANTIOSELECTIVE OLEFIN METATHESIS, AND RELATED METHODS | TRUSTEES OF BOSTON COLLEGE | 2017-11-23 | — | — | US | disclosed |