⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27750837 | 0.74 | — | — | |
| SCHEMBL20474080 | 0.70 | — | — | |
| SCHEMBL3890753 | 0.70 | — | — | |
| SCHEMBL27500821 | 0.68 | — | — | |
| SCHEMBL8468531 | 0.68 | — | — | |
| SCHEMBL27452686 | 0.68 | — | — | |
| SCHEMBL5090138 | 0.68 | — | — | |
| SCHEMBL27835281 | 0.68 | — | — | |
| SCHEMBL4633093 | 0.68 | — | — | |
| SCHEMBL6812513 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000178293-A | SEMI-SANDWICH COMPLEX OF NON-CROSS-LINKED MONONUCLE, BISALKYL METAL HAVING POLYMERIZATION ACTIVITY BASED ON RARE EARTH METAL | BASF AG | 2000-06-27 | — | — | JP | disclosed |