⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9438361 | 0.79 | — | — | |
| SCHEMBL1246479 | 0.73 | — | — | |
| Bromide SCHEMBL11652645 | 0.71 | — | — | |
| SCHEMBL20994001 | 0.70 | — | — | |
| SCHEMBL279830 | 0.69 | — | — | |
| SCHEMBL25213901 | 0.69 | — | — | |
| SCHEMBL13826060 | 0.69 | — | — | |
| SCHEMBL21670451 | 0.69 | — | — | |
| SCHEMBL13947053 | 0.69 | — | — | |
| SCHEMBL19036788 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007087434-A2 | METHOD FOR THE PRODUCTION OF COPPER AND ZINC MONO-AND BI-METALLIC IMIDAZOLATES | U.S. BORAX INC. (US) | 2007-08-02 | — | — | WO | disclosed |
| US-4240943-A | WATER DISPERSIBLE URETHANE PREPOLYMER AND WATER SOLUBLE METHYLOL COMPOUND, GLYOXALAMIDE ADDUCT OR BIS-HYDROXYETHYL SULFONE | DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) | 1980-12-23 | — | — | US | disclosed |