⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9456152 | 0.75 | — | — | |
| SCHEMBL9456155 | 0.62 | — | — | |
| SCHEMBL9281996 | 0.59 | — | — | |
| SCHEMBL9282078 | 0.59 | — | — | |
| SCHEMBL6244236 | 0.59 | — | — | |
| SCHEMBL51759 | 0.53 | — | — | |
| SCHEMBL3334930 | 0.50 | — | — | |
| Ammonia Solution, Strong SCHEMBL1357155 | 0.47 | — | — | |
| Hydrochloric Acid SCHEMBL6699113 | 0.47 | — | — | |
| Water SCHEMBL4029249 | 0.47 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105254795-B | A kind of exterior wall engineering coating emulsion and preparation method thereof | 佛山市顺德区巴德富实业有限公司 | 2018-01-09 | — | — | CN | disclosed |