⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27680929 | 0.96 | CA12 (0.83) | — | |
| SCHEMBL5314937 | 0.95 | CA12 (1.00) | — | |
| SCHEMBL15381 | 0.95 | — | — | |
| Iodide SCHEMBL8346129 | 0.91 | CA12 (0.91) | — | |
| SCHEMBL25342018 | 0.91 | CA12 (1.00) | — | |
| SCHEMBL25342922 | 0.91 | CA12 (1.00) | — | |
| SCHEMBL15797 | 0.91 | CA12 (1.00) | — | |
| SCHEMBL581603 | 0.91 | CA12 (1.00) | — | |
| Ammonia Solution, Strong SCHEMBL902204 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL11674996 | 0.91 | — | — |
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-105331979-B | A kind of aluminium chemical polishing liquid and the polishing method using the polishing fluid | 上海瑞特良化工有限公司 | 2017-12-26 | — | — | CN | disclosed |