⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11685761 | 0.69 | — | — | |
| SCHEMBL11029432 | 0.69 | — | — | |
| SCHEMBL6379764 | 0.67 | — | — | |
| SCHEMBL5844483 | 0.64 | ALDH1A1 (0.32) | — | |
| SCHEMBL10796116 | 0.64 | — | — | |
| SCHEMBL7471050 | 0.64 | — | — | |
| SCHEMBL5076748 | 0.63 | MAPT (0.36) | — | |
| SCHEMBL13656852 | 0.62 | — | — | |
| Trimethylammonium SCHEMBL27512682 | 0.62 | — | — | |
| SCHEMBL23175000 | 0.60 | — | — |
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-7511104-B2 | Polyolefins made by catalyst comprising a noncoordinating anion and articles comprising them | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2009-03-31 | — | — | US | disclosed |