⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL338317 | 0.96 | — | — | |
| SCHEMBL4575306 | 0.77 | — | — | |
| Tert-Butanol SCHEMBL816081 | 0.75 | — | — | |
| SCHEMBL686973 | 0.75 | — | — | |
| Ammonia Solution, Strong SCHEMBL17670018 | 0.72 | — | — | |
| SCHEMBL28987004 | 0.72 | — | — | |
| SCHEMBL28499397 | 0.72 | — | — | |
| SCHEMBL28553274 | 0.72 | — | — | |
| Phosphonic Acid SCHEMBL17923495 | 0.72 | THRB (0.38) | — | |
| SCHEMBL968860 | 0.72 | THRB (0.32) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0831065-B1 | A method and a composition for controlling scale in an aqueous system using a synergistic composition | CALGON CORP (US) | 2000-07-19 | — | — | EP | claimed |
| US-5772913-A | POLYETHER POLYAMINO METHYLENE PHOSPHONATE, TERPOLYMER OF ACRYLIC ACID, SULFOPHENOXYMETHALLYL ETHER AND MALEIC ACID, HYDROXYPHOSPHONOACETIC ACID, PHOSPHONOCARBOXYLIC ACID COPOLYMER | CALGON CORPORATION (US) | 1998-06-30 | — | — | US | claimed |
| EP-0831065-A1 | A method for controlling scale in an aqueous system using a synergistic composition | Calgon Corporation (US) | 1998-03-25 | — | — | EP | claimed |
| US-5707529-A | SYNERGISTIC MIXTURE CONTAINING POLYETHER TETRAKIS/AMINOMETHYLENEPHOSPHONATE/ | CALGON CORPORATION (US) | 1998-01-13 | — | — | US | claimed |
| EP-0831065-B1 | A method and a composition for controlling scale in an aqueous system using a synergistic composition | CALGON CORP (US) | 2000-07-19 | — | — | EP | disclosed |
| US-5772913-A | POLYETHER POLYAMINO METHYLENE PHOSPHONATE, TERPOLYMER OF ACRYLIC ACID, SULFOPHENOXYMETHALLYL ETHER AND MALEIC ACID, HYDROXYPHOSPHONOACETIC ACID, PHOSPHONOCARBOXYLIC ACID COPOLYMER | CALGON CORPORATION (US) | 1998-06-30 | — | — | US | disclosed |
| US-5772913-A | POLYETHER POLYAMINO METHYLENE PHOSPHONATE, TERPOLYMER OF ACRYLIC ACID, SULFOPHENOXYMETHALLYL ETHER AND MALEIC ACID, HYDROXYPHOSPHONOACETIC ACID, PHOSPHONOCARBOXYLIC ACID COPOLYMER | CALGON CORPORATION (US) | 1998-06-30 | — | — | US | disclosed |
| EP-0831065-A1 | A method for controlling scale in an aqueous system using a synergistic composition | Calgon Corporation (US) | 1998-03-25 | — | — | EP | disclosed |
| EP-0831065-A1 | A method for controlling scale in an aqueous system using a synergistic composition | Calgon Corporation (US) | 1998-03-25 | — | — | EP | disclosed |
| US-5707529-A | SYNERGISTIC MIXTURE CONTAINING POLYETHER TETRAKIS/AMINOMETHYLENEPHOSPHONATE/ | CALGON CORPORATION (US) | 1998-01-13 | — | — | US | disclosed |