⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13249571 | 0.83 | — | — | |
| SCHEMBL21028412 | 0.81 | — | — | |
| SCHEMBL295240 | 0.81 | GNAI3 (0.35) | — | |
| SCHEMBL12744420 | 0.80 | SLC2A1 (0.40) | — | |
| SCHEMBL12533318 | 0.78 | — | — | |
| SCHEMBL11140564 | 0.75 | — | — | |
| SCHEMBL4710169 | 0.75 | GNAI3 (0.46) | — | |
| SCHEMBL9456737 | 0.75 | GNAI3 (0.46) | — | |
| SCHEMBL9492627 | 0.75 | GNAI3 (0.46) | — | |
| SCHEMBL7661667 | 0.73 | SQLE (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7910642-B2 | Stabilization of polyether polyol, polyester polyol or polyurethane compositions | BASF SE (DE) | 2011-03-22 | — | — | US | disclosed |
| US-20080033080-A1 | Stabilization of Polyether Polyol, Polyester Polyol or Polyurethane Compositions | BASF SE (DE) | 2008-02-07 | — | — | US | disclosed |