⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL372458 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL959923 | 0.95 | — | — | |
| Bromide SCHEMBL2760953 | 0.95 | — | — | |
| Iodide SCHEMBL1758400 | 0.95 | — | — | |
| SCHEMBL349593 | 0.89 | — | — | |
| SCHEMBL27983931 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL961677 | 0.87 | — | — | |
| Iodide SCHEMBL1894751 | 0.87 | — | — | |
| Bromide SCHEMBL1657078 | 0.87 | — | — | |
| Fluoride SCHEMBL1898729 | 0.87 | — | — |
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-109524617-A | Activation of metal in the passive state method and its purposes | 泰克年研究发展基金会公司 | 2019-03-26 | — | — | CN | disclosed |
| CN-106415919-A | Passive metal activation method and application thereof | 泰克年研究发展基金会公司 | 2017-02-15 | — | — | CN | disclosed |