⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11810828 | 1.00 | — | — | |
| SCHEMBL10415191 | 0.85 | — | — | |
| SCHEMBL2608976 | 0.83 | — | — | |
| SCHEMBL14587077 | 0.81 | — | — | |
| SCHEMBL9979885 | 0.81 | — | — | |
| SCHEMBL12670218 | 0.81 | — | — | |
| SCHEMBL686433 | 0.81 | — | — | |
| SCHEMBL681456 | 0.81 | — | — | |
| SCHEMBL1057616 | 0.78 | — | — | |
| SCHEMBL1357404 | 0.78 | — | — |
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-7683180-B2 | Group 8 transition metal carbene complexes as enantionselective olefin metathesis catalysts | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2010-03-23 | — | — | US | disclosed |