⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28961166 | 0.86 | POLB (0.35) | — | |
| SCHEMBL27518236 | 0.86 | POLB (0.35) | — | |
| SCHEMBL29923612 | 0.83 | THRB (0.34) | — | |
| SCHEMBL5815964 | 0.76 | — | — | |
| SCHEMBL11037870 | 0.76 | — | — | |
| SCHEMBL29152644 | 0.74 | SMN1; SMN2 (0.33) | — | |
| Ammonia Solution, Strong SCHEMBL28154471 | 0.74 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL28326518 | 0.74 | SMN1; SMN2 (0.33) | — | |
| SCHEMBL11385959 | 0.73 | CHRNB2 (0.31) | — | |
| SCHEMBL17334174 | 0.72 | CFTR (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-1053061-A | Aryl-hydroxy amine derivatives and weedicide thereof | HOKKO CHEM IND CO (JP) | 1991-07-17 | — | — | CN | claimed |
| CN-1053061-A | Aryl-hydroxy amine derivatives and weedicide thereof | HOKKO CHEM IND CO (JP) | 1991-07-17 | — | — | CN | disclosed |