⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2080192 | 0.82 | TSHR (0.32) | — | |
| SCHEMBL1960546 | 0.79 | DGKA (0.33) | — | |
| SCHEMBL9850370 | 0.79 | DGKA (0.33) | — | |
| SCHEMBL10722791 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL10946598 | 0.76 | DGKA (0.32) | — | |
| SCHEMBL124024 | 0.76 | DGKA (0.32) | — | |
| SCHEMBL9559121 | 0.76 | TSHR (0.39) | — | |
| SCHEMBL2080189 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL10725123 | 0.71 | ALDH1A1 (0.37) | — | |
| SCHEMBL10353509 | 0.71 | ALDH1A1 (0.37) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1943306-B1 | LOW TEMPERATURE INITIATORS FOR IMPROVING THE RUBBER PHASE VOLUME OF HIPS FORMULATIONS | FINA TECHNOLOGY (US) | 2012-07-18 | — | — | EP | claimed |
| EP-1943306-B1 | LOW TEMPERATURE INITIATORS FOR IMPROVING THE RUBBER PHASE VOLUME OF HIPS FORMULATIONS | FINA TECHNOLOGY (US) | 2012-07-18 | — | — | EP | disclosed |
| US-7754817-B2 | Low temperature initiators for improving the rubber phase volume of HIPS formulations | FINA TECHNOLOGY, INC. (US) | 2010-07-13 | — | — | US | disclosed |
| US-20070100079-A1 | Low temperature initiators for improving the rubber phase volume of HIPS formulations | FINA TECHNOLOGY, INC. | 2007-05-03 | — | — | US | disclosed |
| US-6608150-B1 | Two organic peroxide initiators in styrene monomer suspension and one being an intermediate temperature peroxide, they have different one hour half life decomposition temperatures | ATOFINA CHEMICALS, INC. | 2003-08-19 | — | — | US | disclosed |