⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5890091 | 0.95 | — | — | |
| SCHEMBL5890242 | 0.93 | — | — | |
| SCHEMBL5889783 | 0.92 | — | — | |
| SCHEMBL5891452 | 0.91 | — | — | |
| SCHEMBL5890842 | 0.91 | — | — | |
| SCHEMBL5890995 | 0.90 | — | — | |
| SCHEMBL5889867 | 0.89 | — | — | |
| SCHEMBL5890321 | 0.89 | — | — | |
| SCHEMBL5890424 | 0.87 | — | — | |
| SCHEMBL5890610 | 0.87 | — | — |
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-7122498-B2 | Metallocenes and catalyst compositions derived therefrom | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2006-10-17 | — | — | US | disclosed |