⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1678861 | 0.72 | — | — | |
| SCHEMBL6142953 | 0.72 | ALDH1A1 (0.39) | — | |
| SCHEMBL590442 | 0.70 | — | — | |
| SCHEMBL25968477 | 0.69 | — | — | |
| SCHEMBL18124543 | 0.69 | — | — | |
| SCHEMBL15213030 | 0.69 | — | — | |
| SCHEMBL757573 | 0.69 | — | — | |
| SCHEMBL14503037 | 0.69 | — | — | |
| Water SCHEMBL8214728 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL27563355 | 0.67 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20240141131-A1 | ANTIPOLYMERANT COMPOSITIONS WITH NAPHTHOQUINONE AND HYDROXYLAMINE AND METHODS OF USING | ECOLAB USA INC. | 2024-05-02 | — | — | US | claimed |
| WO-2024081354-A1 | ANTIPOLYMERANT COMPOSITIONS WITH NAPHTHOQUINONE AND HYDROXYLAMINE AND METHODS OF USING | ECOLAB USA INC. (US) | 2024-04-18 | — | — | WO | claimed |
| US-20240141131-A1 | ANTIPOLYMERANT COMPOSITIONS WITH NAPHTHOQUINONE AND HYDROXYLAMINE AND METHODS OF USING | ECOLAB USA INC. | 2024-05-02 | — | — | US | disclosed |
| WO-2024081354-A1 | ANTIPOLYMERANT COMPOSITIONS WITH NAPHTHOQUINONE AND HYDROXYLAMINE AND METHODS OF USING | ECOLAB USA INC. (US) | 2024-04-18 | — | — | WO | disclosed |
| US-20160177420-A1 | SOLVENT EXTRACTION OF SCANDIUM FROM LEACH SOLUTIONS | SCANDIUM INTERNATIONAL MINING CORPORATION | 2016-06-23 | — | — | US | disclosed |