⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19909665 | 0.93 | — | — | |
| SCHEMBL19909615 | 0.91 | — | — | |
| SCHEMBL19909616 | 0.86 | — | — | |
| SCHEMBL19909635 | 0.79 | ALOX5 (0.37) | — | |
| SCHEMBL19909634 | 0.74 | ALOX5 (0.33) | — | |
| SCHEMBL16883688 | 0.70 | GAA (0.33) | — | |
| SCHEMBL16883657 | 0.70 | GAA (0.33) | — | |
| SCHEMBL15430188 | 0.69 | ALOX5 (0.40) | — | |
| SCHEMBL19325321 | 0.69 | GAA (0.35) | — | |
| SCHEMBL15430381 | 0.68 | TDP1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2872496-B1 | POLYGLYCOL BIS-[3-(7-TERT-BUTYL-2-OXO-3-PHENYL-3H-BENZOFURAN-5-YL-)PROPANOYL]DERIVATIVES AS STABILIZERS OF ORGANIC MATERIAL | BASF SE (DE) | 2018-02-28 | — | — | EP | disclosed |