⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL379399 | 0.73 | GAA (0.37) | — | |
| SCHEMBL2912919 | 0.73 | — | — | |
| SCHEMBL28279306 | 0.73 | GAA (0.41) | — | |
| SCHEMBL7799565 | 0.70 | — | — | |
| SCHEMBL438903 | 0.68 | SLC1A2 (0.42) | — | |
| SCHEMBL2914182 | 0.68 | — | — | |
| SCHEMBL93390 | 0.65 | — | — | |
| SCHEMBL7566570 | 0.65 | ATM (0.40) | — | |
| SCHEMBL2911476 | 0.64 | — | — | |
| SCHEMBL7719617 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1233989-A2 | INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS | Crompton Corporation (US) | 2002-08-28 | — | — | EP | disclosed |
| WO-2001040319-A2 | INHIBITION OF POLYMERIZATION OF UNSATURATED MONOMERS | CROMPTON CORPORATION (US) | 2001-06-07 | — | — | WO | disclosed |