⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL824510 | 0.86 | IDO1 (0.30) | — | |
| SCHEMBL7643336 | 0.85 | — | — | |
| SCHEMBL7616916 | 0.83 | — | — | |
| SCHEMBL207883 | 0.81 | CYP1A2 (0.30) | — | |
| SCHEMBL30450465 | 0.81 | CYP1A2 (0.30) | — | |
| SCHEMBL7640004 | 0.81 | APEX1 (0.32) | — | |
| SCHEMBL21018012 | 0.79 | APEX1 (0.32) | — | |
| SCHEMBL10039487 | 0.79 | GABRA1 (0.30) | — | |
| SCHEMBL29793940 | 0.79 | GABRA1 (0.30) | — | |
| SCHEMBL7616436 | 0.78 | — | — |
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-6465548-B1 | 6-HYDROXYCHROMAN DERIVATIVE WITH PHOSPHORUS AND PHENOLIC ANTIOXIDANTS; HEAT, LIGHT AND OXIDATION STABILITY DURING MOLDING | YOSHITOMI FINE CHEMICALS, LTD. (JP) | 2002-10-15 | — | — | US | disclosed |