⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23733374 | 0.92 | — | — | |
| SCHEMBL23005495 | 0.73 | — | — | |
| SCHEMBL24252223 | 0.72 | — | — | |
| SCHEMBL17577374 | 0.71 | — | — | |
| SCHEMBL19392137 | 0.69 | — | — | |
| SCHEMBL821304 | 0.67 | — | — | |
| SCHEMBL20781663 | 0.63 | — | — | |
| SCHEMBL19288339 | 0.60 | — | — | |
| SCHEMBL575891 | 0.59 | — | — | |
| SCHEMBL12832572 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022034151-A1 | ADDITIVE FOR REDUCING POLYURETHANE FOAM DEGRADATION | HUNTSMAN INTERNATIONAL LLC (US) | 2022-02-17 | — | — | WO | disclosed |