⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3022929 | 0.82 | — | — | |
| SCHEMBL6950834 | 0.82 | ALDH1A1 (0.56) | — | |
| SCHEMBL8295 | 0.82 | — | — | |
| SCHEMBL2352707 | 0.79 | ALDH1A1 (0.43) | — | |
| SCHEMBL28791576 | 0.78 | — | — | |
| SCHEMBL28345369 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL11801654 | 0.78 | — | — | |
| Methyl Alcohol SCHEMBL15233825 | 0.78 | ALDH1A1 (0.53) | — | |
| SCHEMBL28352291 | 0.78 | — | — | |
| SCHEMBL28824476 | 0.78 | — | — |
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-100436488-C | Anti-fouling agent and method for producing the same and manufacture of polymer using it | KURARAY CO (JP) | 2008-11-26 | — | — | CN | disclosed |
| CN-1644633-A | Anti-fouling agent and method for producing the same and manufacture of polymer using it | KURARAY CO (JP) | 2005-07-27 | — | — | CN | disclosed |