⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14969640 | 0.90 | TSHR (0.37) | — | |
| SCHEMBL543753 | 0.88 | — | — | |
| SCHEMBL27491793 | 0.84 | TSHR (0.50) | — | |
| SCHEMBL27635168 | 0.84 | — | — | |
| SCHEMBL28555009 | 0.84 | — | — | |
| Ethylene Glycol SCHEMBL25182687 | 0.84 | TSHR (0.50) | — | |
| SCHEMBL28332936 | 0.84 | — | — | |
| Methyl Alcohol SCHEMBL28703521 | 0.80 | TSHR (0.47) | — | |
| Water SCHEMBL28890405 | 0.80 | TSHR (0.47) | — | |
| SCHEMBL2697437 | 0.79 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4981601-A | QUATERNARY AMINE, ETHOXYLATED ALKYLPHENOL, SOLVENT | HALLIBURTON COMPANY (US) | 1991-01-01 | — | — | US | claimed |
| US-4823874-A | MIXTURE OF ETHOXYALKYLATE ALKYLPHENOL DISPERSANT, ETHYLENE GLYCOL, METHANOL AND WATER | HALLIBURTON COMPANY (US) | 1989-04-25 | — | — | US | claimed |
| CN-107345040-B | A kind of preparation method of polyacrylate/spherical hollow zinc laminated film | 陕西科技大学 | 2019-09-10 | — | — | CN | disclosed |
| CN-107345040-A | A kind of preparation method of polyacrylate/spherical hollow zinc laminated film | 陕西科技大学 | 2017-11-14 | — | — | CN | disclosed |
| CN-107167356-A | In a kind of urine after cell dyeing quick colour-developing coloring agent and its application method | 迪瑞医疗科技股份有限公司 | 2017-09-15 | — | — | CN | disclosed |
| WO-2013047729-A1 | ANTIGEN-BINDING MOLECULE INDUCING IMMUNE RESPONSE TO TARGET ANTIGEN | 中外製薬株式会社 (JP) | 2013-04-04 | — | — | WO | disclosed |
| US-4981601-A | QUATERNARY AMINE, ETHOXYLATED ALKYLPHENOL, SOLVENT | HALLIBURTON COMPANY (US) | 1991-01-01 | — | — | US | disclosed |
| US-4823874-A | MIXTURE OF ETHOXYALKYLATE ALKYLPHENOL DISPERSANT, ETHYLENE GLYCOL, METHANOL AND WATER | HALLIBURTON COMPANY (US) | 1989-04-25 | — | — | US | disclosed |