⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8133628 | 0.74 | — | — | |
| SCHEMBL8966267 | 0.70 | — | — | |
| SCHEMBL173143 | 0.67 | — | — | |
| Trimethylammonium SCHEMBL674054 | 0.67 | — | — | |
| SCHEMBL1033917 | 0.65 | — | — | |
| SCHEMBL1030695 | 0.65 | — | — | |
| Trimethylammonium SCHEMBL28758519 | 0.63 | — | — | |
| SCHEMBL6436118 | 0.63 | — | — | |
| SCHEMBL20376089 | 0.60 | — | — | |
| SCHEMBL8966970 | 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-20190345304-A1 | Process for Foaming Polyolefin Compositions Using a Fluororesin/Azodicarbonamide Mixture as a Nucleating Agent | UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC | 2019-11-14 | — | — | US | disclosed |