⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21655069 | 0.80 | — | — | |
| SCHEMBL21655128 | 0.75 | — | — | |
| SCHEMBL22871558 | 0.73 | — | — | |
| SCHEMBL21655070 | 0.73 | — | — | |
| SCHEMBL22871557 | 0.64 | — | — | |
| SCHEMBL14763831 | 0.62 | — | — | |
| SCHEMBL19827927 | 0.62 | — | — | |
| SCHEMBL14093979 | 0.60 | — | — | |
| SCHEMBL5076390 | 0.60 | — | — | |
| SCHEMBL5716899 | 0.59 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| US-10889662-B2 | Metallocene-supported catalyst and method of preparing polyolefin using the same | LG CHEM, LTD. (KR) | 2021-01-12 | — | — | US | disclosed |