⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5116420 | 1.00 | — | — | |
| SCHEMBL669397 | 1.00 | — | — | |
| SCHEMBL229347 | 0.71 | — | — | |
| SCHEMBL205123 | 0.71 | — | — | |
| SCHEMBL258389 | 0.71 | — | — | |
| SCHEMBL322709 | 0.67 | — | — | |
| SCHEMBL10631463 | 0.67 | — | — | |
| SCHEMBL385104 | 0.67 | — | — | |
| SCHEMBL385105 | 0.67 | — | — | |
| SCHEMBL20856790 | 0.65 | — | — |
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-2018093709-A1 | POLYURETHANE FOAMS CO-BLOWN WITH A MIXTURE OF A HYDROCARBON AND A HALOGENATED OLEFIN | COVESTRO LLC (US) | 2018-05-24 | — | — | WO | disclosed |