⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8459250 | 0.79 | — | — | |
| SCHEMBL251040 | 0.71 | PKM (0.36) | — | |
| SCHEMBL250534 | 0.67 | — | — | |
| SCHEMBL252105 | 0.67 | — | — | |
| SCHEMBL14883739 | 0.67 | — | — | |
| SCHEMBL4350663 | 0.67 | — | — | |
| SCHEMBL5144053 | 0.65 | — | — | |
| SCHEMBL2768575 | 0.64 | — | — | |
| SCHEMBL251331 | 0.63 | — | — | |
| SCHEMBL9659080 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009019219-A2 | METHODS OF USING A SOLVENT OR A FOAM BLOWING AGENT | Solvay (Société Anonyme) (BE) | 2009-02-12 | — | — | WO | claimed |
| WO-2009019219-A2 | METHODS OF USING A SOLVENT OR A FOAM BLOWING AGENT | Solvay (Société Anonyme) (BE) | 2009-02-12 | — | — | WO | disclosed |