⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2343587 | 0.78 | — | — | |
| SCHEMBL6413 | 0.78 | — | — | |
| SCHEMBL21693874 | 0.76 | — | — | |
| SCHEMBL6050879 | 0.76 | — | — | |
| SCHEMBL2178197 | 0.74 | — | — | |
| SCHEMBL536602 | 0.74 | — | — | |
| Ammonia Solution, Strong SCHEMBL3401376 | 0.74 | — | — | |
| SCHEMBL5855816 | 0.74 | — | — | |
| Helium SCHEMBL21981839 | 0.74 | — | — | |
| SCHEMBL1059751 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993025590-A1 | HIGH TEMPERATURE POLYMERIZATION PROCESS USING IONIC CATALYSTS TO PRODUCE POLYOLEFINS | EXXON CHEMICAL PATENTS INC. (US) | 1993-12-23 | — | — | WO | disclosed |