⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14777752 | 1.00 | — | — | |
| SCHEMBL25688127 | 1.00 | — | — | |
| SCHEMBL6161420 | 1.00 | — | — | |
| SCHEMBL6161812 | 1.00 | — | — | |
| SCHEMBL25688126 | 1.00 | — | — | |
| SCHEMBL6165114 | 1.00 | — | — | |
| SCHEMBL14779743 | 1.00 | — | — | |
| SCHEMBL199605 | 1.00 | — | — | |
| SCHEMBL732380 | 0.97 | — | — | |
| SCHEMBL4024768 | 0.91 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11685705-B2 | Method for producing α-allylated cycloalkanone | KAO CORPORATION (JP) | 2023-06-27 | — | — | US | disclosed |
| US-20130072648-A1 | SOLID CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-03-21 | — | — | US | disclosed |