⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3689122 | 0.86 | — | — | |
| SCHEMBL7126872 | 0.76 | — | — | |
| SCHEMBL7711953 | 0.73 | — | — | |
| SCHEMBL7878969 | 0.72 | — | — | |
| SCHEMBL27620396 | 0.72 | — | — | |
| SCHEMBL27601799 | 0.72 | — | — | |
| SCHEMBL27620380 | 0.71 | — | — | |
| SCHEMBL27725322 | 0.71 | ESR1 (0.33) | — | |
| SCHEMBL27601794 | 0.68 | CPS1 (0.36) | — | |
| SCHEMBL22279635 | 0.67 | KCNH2 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-100405220-C | Acid-decomposable resin composition containing ketone-aldehyde copolymer | NIPPON SODA CO (JP) | 2008-07-23 | — | — | CN | disclosed |
| CN-1630835-A | Acid-decomposable resin composition containing ketone-aldehyde copolymer | NIPPON SODA CO (JP) | 2005-06-22 | — | — | CN | disclosed |