⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19779370 | 1.00 | — | — | |
| SCHEMBL19322654 | 1.00 | — | — | |
| SCHEMBL14009898 | 0.81 | — | — | |
| SCHEMBL14273370 | 0.76 | — | — | |
| SCHEMBL25143352 | 0.73 | — | — | |
| SCHEMBL10057632 | 0.72 | TDP1 (0.32) | — | |
| SCHEMBL22017339 | 0.71 | — | — | |
| SCHEMBL18286858 | 0.70 | — | — | |
| SCHEMBL22056323 | 0.69 | ALDH1A1 (0.33) | — | |
| Butadiene SCHEMBL27376162 | 0.69 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106518757-B | A kind of method that microwave method synthesizes the halogenated -3- substituted hydrocarbon radical sulfonyl pyridine of 2- and its intermediate | 山东师范大学 | 2019-03-19 | — | — | CN | disclosed |
| EP-1778174-A1 | AMINOBUTADIENE-BASED UV SCREENS | Fuji Photo Film B.V (NL) | 2007-05-02 | — | — | EP | disclosed |
| WO-2006016806-A1 | AMINOBUTADIENE-BASED UV SCREENS | FUJIFILM MANUFACTURING EUROPE B.V. (NL) | 2006-02-16 | — | — | WO | disclosed |