⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2755847 | 0.97 | — | — | |
| SCHEMBL9619002 | 0.73 | CYP1A2 (0.42) | — | |
| SCHEMBL109623 | 0.73 | — | — | |
| SCHEMBL1368247 | 0.73 | — | — | |
| SCHEMBL2085562 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL11088216 | 0.71 | — | — | |
| SCHEMBL4694543 | 0.71 | — | — | |
| SCHEMBL9085970 | 0.69 | CYP1A2 (0.44) | — | |
| SCHEMBL3065037 | 0.69 | — | — | |
| SCHEMBL15844958 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1166851-B1 | Method of removing heavy metals from waste gases | NIPPON CATALYTIC CHEM IND (JP) | 2004-12-29 | — | — | EP | disclosed |
| US-6638432-B2 | Burning to produce exhaust gas, gas-liquid containing an alkali to precipitate heavy metals and coagulating to collect in the bottom for removal | NIPPON SHOKUBAI CO., LTD. (JP) | 2003-10-28 | — | — | US | disclosed |
| US-20020000413-A1 | Method of treating waste liquid | NIPPON SHOKUBAI CO., LTD. (JP) | 2002-01-03 | — | — | US | disclosed |
| EP-1166851-A1 | Method of removing heavy metals from waste gases | NIPPON SHOKUBAI CO., LTD. (JP) | 2002-01-02 | — | — | EP | disclosed |