⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28310985 | 0.77 | — | — | |
| SCHEMBL12973873 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL27783359 | 0.75 | — | — | |
| SCHEMBL9351011 | 0.67 | KDM4A (0.36) | — | |
| SCHEMBL9350809 | 0.65 | KDM4A (0.50) | — | |
| SCHEMBL19784972 | 0.65 | — | — | |
| SCHEMBL145524 | 0.65 | — | — | |
| Butane SCHEMBL11337240 | 0.64 | — | — | |
| SCHEMBL27846133 | 0.64 | — | — | |
| SCHEMBL28115548 | 0.63 | — | — |
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-101443270-B | Method of stabilizing silica-containing anionic microparticles in hard water | NALCO CO | 2013-01-16 | — | — | CN | disclosed |
| CN-101443270-A | Method of stabilizing silica-containing anionic microparticles in hard water | NALCO CO (US) | 2009-05-27 | — | — | CN | disclosed |