⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13550987 | 0.80 | — | — | |
| SCHEMBL2554995 | 0.79 | — | — | |
| SCHEMBL9000225 | 0.79 | — | — | |
| SCHEMBL123122 | 0.79 | — | — | |
| SCHEMBL2785845 | 0.73 | — | — | |
| SCHEMBL10706401 | 0.73 | — | — | |
| SCHEMBL2262941 | 0.72 | — | — | |
| SCHEMBL5475612 | 0.72 | — | — | |
| SCHEMBL15192850 | 0.72 | — | — | |
| SCHEMBL15192851 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7968673-B2 | Polyazacrown-based materials for mercury capture and synthesis of those materials | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2011-06-28 | — | — | US | disclosed |
| US-7846587-B2 | noncrystalline fluorine containing polyethers; perfluoropolyethers; high molecular weight, high ionic conductivity at room temperature, low viscosity, nonflammable, oxidation resistance; for use as electrolyte of lithium secondary batteries, capacitors, and solar cells | DAIKIN INDUSTRIES, LTD. (JP) | 2010-12-07 | — | — | US | disclosed |
| US-20090057233-A1 | Polyazacrown-based materials for mercury capture and synthesis of those materials | BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) | 2009-03-05 | — | — | US | disclosed |
| US-20080020275-A1 | noncrystalline fluorine containing polyethers; perfluoropolyethers; high molecular weight, high ionic conductivity at room temperature, low viscosity, nonflammable, oxidation resistance; for use as electrolyte of lithium secondary batteries, capacitors, and solar cells | DAIKIN INDUSTRIES, LTD. (JP) | 2008-01-24 | — | — | US | disclosed |
| US-20050112066-A1 | Complexes of cyclic polyaza chelators with cations of alkaline earth metals for enhanced biological activity | CONCAT LP, A CALIFORNIA LIMITED PARTNERSHIP (US) | 2005-05-26 | — | — | US | disclosed |
| US-6048991-A | Preparation of epoxides | BASF AKTIENGESELLSCHAFT (DE) | 2000-04-11 | — | — | US | disclosed |
| US-5916430-A | Preparation of epoxides | BASF AKTIENGESELLSCHAFT (DE) | 1999-06-29 | — | — | US | disclosed |
| US-5874573-A | Compounds with chelation affinity and selectivity for first transition series elements: use in medical therapy | CONCAT, INC. (US) | 1999-02-23 | — | — | US | disclosed |
| EP-0485783-B1 | Process for producing epoxy compounds | BASF AG (DE) | 1995-01-11 | — | — | EP | disclosed |
| EP-0485783-A2 | Process for producing epoxy compounds | BASF Aktiengesellschaft (DE) | 1992-05-20 | — | — | EP | disclosed |