⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23239269 | 0.82 | — | — | |
| SCHEMBL724564 | 0.78 | GRIK1 (0.46) | — | |
| Ethylamine SCHEMBL27631440 | 0.78 | GRIK1 (0.46) | — | |
| SCHEMBL1033713 | 0.77 | — | — | |
| Chloromethane SCHEMBL203881 | 0.74 | GRIK1 (0.43) | — | |
| SCHEMBL6152779 | 0.74 | THRB (0.50) | — | |
| SCHEMBL3628023 | 0.73 | — | — | |
| SCHEMBL18792668 | 0.72 | PAOX (0.54) | — | |
| SCHEMBL290310 | 0.71 | GRIK1 (0.44) | — | |
| SCHEMBL8305292 | 0.71 | — | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0881895-A1 | PRODUCTION OF IMPROVED PEROXY PREPARATIONS | Peroxid-Chemie GmbH (DE) | 1998-12-09 | — | — | EP | claimed |
| WO-1997028781-A1 | PRODUCTION OF IMPROVED PEROXY PREPARATIONS | PEROXID-CHEMIE GMBH (DE) | 1997-08-14 | — | — | WO | claimed |
| US-20180036249-A1 | PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF CANCER | BAYER HEALTHCARE LLC (US) | 2018-02-08 | — | — | US | disclosed |
| US-7754669-B2 | Detergent composition with enhanced whitening power | THE DIAL CORPORATION (US) | 2010-07-13 | — | — | US | disclosed |
| EP-1868579-A1 | PHARMACEUTICAL COMPOSITION COMPRISING AN OMEGA-CARBOXYARYL SUBSTITUTED DIPHENYL UREA FOR THE TREATMENT OF CANCER | Bayer HealthCare AG (DE) | 2007-12-26 | — | — | EP | disclosed |
| US-20070270324-A1 | HIGH WATER CONTENT ENZYMATIC HEAVY DUTY LIQUID DETERGENT | THE DIAL CORPORATION | 2007-11-22 | — | — | US | disclosed |
| US-20070215271-A1 | Covering article and associated method | MCCLINTIC SHAWN A | 2007-09-20 | — | — | US | disclosed |
| US-20070207284-A1 | Barrier article and method | MCCLINTIC SHAWN A | 2007-09-06 | — | — | US | disclosed |
| US-20060281865-A1 | Polymer alloy, crosslinked object, and fuel hose | ZEON CORPORATION (JP) | 2006-12-14 | — | — | US | disclosed |
| WO-2006094626-A1 | PHARMACEUTICAL COMPOSITION COMPRISING AN OMEGA- CARBOXYARYL SUBSTITUTED DIPHENYL UREA FOR THE TREATMENT OF CANCER | BAYER HEALTHCARE AG (DE) | 2006-09-14 | — | — | WO | disclosed |
| US-20060183656-A1 | Detergent composition with enhanced whitening power | HENKEL AG & CO. KGAA (DE) | 2006-08-17 | — | — | US | disclosed |
| EP-1640413-A2 | POLYMER ALLOY, CROSSLINKED OBJECT, AND FUEL HOSE | ZEON CORPORATION (JP) | 2006-03-29 | — | — | EP | disclosed |
| US-5773489-A | TITANIUM, ZIRCONIUM, YTTRIUM, LANTHANUM, TANTALUM, ALUMINUM OXIDES LINKED TO ORGANIC REACTIVE COMPOUND | GC CORPORATION (JP) | 1998-06-30 | — | — | US | disclosed |
| US-3977971-A | Method of feeding polymers | BETZ LABORATORIES, INC. (US) | 1976-08-31 | — | — | US | disclosed |