⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1053856 | 0.53 | — | — | |
| SCHEMBL11565768 | 0.50 | — | — | |
| SCHEMBL9998880 | 0.50 | — | — | |
| SCHEMBL7014344 | 0.48 | — | — | |
| SCHEMBL1468768 | 0.47 | — | — | |
| SCHEMBL8428241 | 0.45 | — | — | |
| SCHEMBL135047 | 0.45 | — | — | |
| SCHEMBL4411441 | 0.42 | — | — | |
| SCHEMBL18205013 | 0.42 | — | — | |
| SCHEMBL14973298 | 0.42 | — | — |
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-1787513-A2 | Compositions with cyclopropenes | Rohm and Haas Company (US) | 2007-05-23 | — | — | EP | disclosed |