⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1116296 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL222626 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL1313071 | 0.91 | — | — | |
| SCHEMBL162891 | 0.82 | — | — | |
| SCHEMBL3623771 | 0.73 | — | — | |
| SCHEMBL718328 | 0.73 | — | — | |
| Water SCHEMBL2382441 | 0.73 | — | — | |
| SCHEMBL4890561 | 0.73 | — | — | |
| Water SCHEMBL4235154 | 0.73 | — | — | |
| Water SCHEMBL2445961 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2223896-A1 | Hydrophilizing agent, method of producing hydrophilizing agent and hydrophilic product | Sumitomo Chemical Company, Limited (JP) | 2010-09-01 | — | — | EP | disclosed |
| US-20100199887-A1 | HYDROPHILIZING AGENT, METHOD OF PRODUCING A HYDROPHILIZING AGENT AND HYDROPHILIC PRODUCT | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-08-12 | — | — | US | disclosed |