⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL461677 | 0.97 | — | — | |
| SCHEMBL27823590 | 0.95 | — | — | |
| Water SCHEMBL28227041 | 0.95 | — | — | |
| SCHEMBL27519202 | 0.95 | — | — | |
| SCHEMBL1903985 | 0.95 | — | — | |
| SCHEMBL1766010 | 0.95 | — | — | |
| SCHEMBL1766026 | 0.95 | — | — | |
| SCHEMBL1907620 | 0.95 | — | — | |
| SCHEMBL1765840 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL27533888 | 0.95 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109233967-A | A kind of calcium sulfonate grease and preparation method thereof | 江苏澳润新材料有限公司 | 2019-01-18 | — | — | CN | claimed |
| CN-108326229-A | A kind of high intensity releasing agent and preparation method thereof | 苏州捷德瑞精密机械有限公司 | 2018-07-27 | — | — | CN | disclosed |
| CN-106189380-A | A kind of scratch nano silicon coating modification thin slice aluminium powder pigment and preparation method thereof | 合肥旭阳铝颜料有限公司 | 2016-12-07 | — | — | CN | disclosed |