⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL4605883 | 0.96 | — | — | |
| SCHEMBL19127443 | 0.75 | — | — | |
| SCHEMBL3416266 | 0.73 | — | — | |
| SCHEMBL437708 | 0.69 | — | — | |
| SCHEMBL3087277 | 0.69 | LMNA (0.33) | — | |
| SCHEMBL465400 | 0.69 | — | — | |
| SCHEMBL30980 | 0.67 | — | — | |
| SCHEMBL15272666 | 0.67 | — | — | |
| SCHEMBL4559717 | 0.67 | — | — | |
| SCHEMBL4181750 | 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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7795187-B2 | Permeable zone and leak plugging using cross-linking composition comprising zirconium triethanolamine complex | E.I. DU PONT DE NEMOURS AND COMPANY | 2010-09-14 | — | — | US | disclosed |
| US-7730952-B2 | Hydraulic fracturing methods using cross-linking composition comprising zirconium triethanolamine complex | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2010-06-08 | — | — | US | disclosed |
| EP-1984471-A2 | ZIRCONIUM CROSS-LINKING COMPOSITION AND METHODS OF USE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-10-29 | — | — | EP | disclosed |
| WO-2007095018-A2 | ZIRCONIUM CROSS-LINKING COMPOSITION AND METHODS OF USE | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2007-08-23 | — | — | WO | disclosed |
| US-20070191236-A1 | cross-linking composition bistriethanolamine zirconate or tetra-triethanolamine zirconate, N,N,N',N'-tetrakis-(hydroxyisopropyl)ethylenediamine, cross-linkable polymer, water, and polyol; oil fields, hydraulic fracturing and plugging of permeable zones of subterranean formations; well bores | DORF KETAL SPECIALITY CATALYSTS, LLC | 2007-08-16 | — | — | US | disclosed |
| US-20070187101-A1 | Hydraulic fracturing methods using cross-linking composition comprising zirconium triethanolamine complex | DORF KETAL SPECIALITY CATALYSTS, LLC | 2007-08-16 | — | — | US | disclosed |
| US-20070187642-A1 | Zirconium cross-linking composition and methods of use | E. I. DU PONT DE NEMOURS AND COMPANY | 2007-08-16 | — | — | US | disclosed |
| EP-0053222-B1 | TRANSPARENT SOAP | NEUTROGENA CORPORATION (US) | 1984-06-06 | — | — | EP | disclosed |