⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8052436 | 0.67 | ALDH1A1 (0.56) | — | |
| SCHEMBL301943 | 0.67 | — | — | |
| SCHEMBL17688234 | 0.67 | ALDH1A1 (0.31) | — | |
| SCHEMBL2101317 | 0.65 | — | — | |
| SCHEMBL445492 | 0.65 | — | — | |
| SCHEMBL467632 | 0.64 | — | — | |
| SCHEMBL10346404 | 0.64 | ALDH1A1 (0.50) | — | |
| SCHEMBL1479783 | 0.64 | — | — | |
| SCHEMBL2104677 | 0.62 | — | — | |
| SCHEMBL8049972 | 0.61 | ALDH1A1 (0.33) | — |
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-102471581-B | Curable composition for semiconductor encapsulation | ADEKA CORP | 2015-01-28 | — | — | CN | disclosed |
| CN-102471581-A | Curable composition for semiconductor encapsulation | ADEKA CORP | 2012-05-23 | — | — | CN | disclosed |