⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL304628 | 0.83 | — | — | |
| SCHEMBL6131096 | 0.81 | THRB (0.39) | — | |
| SCHEMBL11706070 | 0.79 | — | — | |
| SCHEMBL11709294 | 0.76 | — | — | |
| SCHEMBL1231375 | 0.73 | — | — | |
| SCHEMBL4758783 | 0.71 | THRB (0.31) | — | |
| SCHEMBL4758789 | 0.68 | THRB (0.37) | — | |
| SCHEMBL27445928 | 0.68 | THRB (0.30) | — | |
| SCHEMBL3194654 | 0.66 | — | — | |
| SCHEMBL5589706 | 0.66 | CYSLTR2 (0.33) | — |
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-4044044-A | Anaerobic adhesive composition containing 0.05 to 20 parts per weight of phosphate esters of hydroxyacrylates per 100 parts per weight of polymerizable acrylic ester monomer | SAITO TSUTOMU | 1977-08-23 | — | — | US | disclosed |