⚠ 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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL29157924 | 0.97 | — | — | |
| Phosphoric Acid SCHEMBL16341886 | 0.86 | ALDH1A1 (0.32) | — | |
| SCHEMBL30378180 | 0.71 | — | — | |
| Isopropyl Alcohol SCHEMBL10629858 | 0.66 | — | — | |
| Isopropyl Alcohol SCHEMBL10729977 | 0.66 | ALDH1A1 (1.00) | — | |
| Isopropyl Alcohol SCHEMBL16914724 | 0.66 | — | — | |
| Isopropyl Alcohol SCHEMBL29814955 | 0.66 | — | — | |
| Isopropyl Alcohol SCHEMBL29500440 | 0.66 | — | — | |
| Isopropyl Alcohol SCHEMBL890876 | 0.66 | ALDH1A1 (1.00) | — | |
| Isopropyl Alcohol SCHEMBL385 | 0.66 | — | — |
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-0711733-B1 | Polyether polyamino methylene phosphonates for high pH scale control | CALGON CORP (US) | 1999-08-25 | — | — | EP | claimed |
| EP-0516382-B1 | Polyether polyamino methylene phosphonates for high pH scale control | CALGON CORP (US) | 1997-02-26 | — | — | EP | claimed |
| CN-109072131-A | Laundry detergent composition | 荷兰联合利华有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-106662558-A | Use of fluorescent polymers in marking compositions for diagnostic determination of cleaning performance | 艺康美国股份有限公司 | 2017-05-10 | — | — | CN | disclosed |