⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11217877 | 0.75 | — | — | |
| SCHEMBL3425587 | 0.73 | — | — | |
| SCHEMBL4444546 | 0.73 | — | — | |
| SCHEMBL1408449 | 0.71 | — | — | |
| SCHEMBL5528868 | 0.71 | — | — | |
| SCHEMBL5529294 | 0.69 | — | — | |
| SCHEMBL19122876 | 0.69 | — | — | |
| Isopropyl Alcohol SCHEMBL28684513 | 0.67 | — | — | |
| SCHEMBL11231480 | 0.67 | — | — | |
| Butane SCHEMBL27550372 | 0.65 | TP53 (0.35) | — |
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-20110237824-A1 | Process for Producing Fluoroalkylsulfonylaminoethyl Alpha-Substituted-Acrylate | CENTRAL GLASS COMPANY, LIMITED (JP) | 2011-09-29 | — | — | US | disclosed |