⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL555285 | 0.78 | — | — | |
| SCHEMBL1857099 | 0.76 | — | — | |
| SCHEMBL190201 | 0.76 | — | — | |
| SCHEMBL12794788 | 0.75 | — | — | |
| SCHEMBL1857887 | 0.74 | TP53 (0.35) | — | |
| SCHEMBL28029352 | 0.73 | — | — | |
| SCHEMBL190034 | 0.72 | ALOX15 (0.34) | — | |
| SCHEMBL300762 | 0.72 | CA12 (0.38) | — | |
| SCHEMBL2461687 | 0.70 | ALOX15 (0.34) | — | |
| SCHEMBL134646 | 0.69 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2010588-B1 | Organosilicon polyurea polymers, elastomers manufactured therefrom and their use | HENKEL AG & CO KGAA (DE) | 2012-01-04 | — | — | EP | claimed |
| EP-2010588-A1 | ORGANOSILICON-POLYUREA BASE POLYMER, ELASTOMER PREPARED THEREFROM, PREPARATION THEREOF AND USE OF THE SAME | Henkel AG & Co. KGaA (DE) | 2009-01-07 | — | — | EP | claimed |
| WO-2007118880-A1 | ORGANOSILICON-POLYUREA BASE POLYMER, ELASTOMER PREPARED THEREFROM, PREPARATION THEREOF AND USE OF THE SAME | HENKEL AG & CO. KGAA (DE) | 2007-10-25 | — | — | WO | claimed |
| EP-2010588-B1 | Organosilicon polyurea polymers, elastomers manufactured therefrom and their use | HENKEL AG & CO KGAA (DE) | 2012-01-04 | — | — | EP | disclosed |
| US-20090099291-A1 | ORGANOSILICON-POLYUREA BASE POLYMER, ELASTOMER PREPARED THEREFROM, PREPARATION THEREOF AND USE OF THE SAME | HENKEL AG & CO KGAA (DE) | 2009-04-16 | — | — | US | disclosed |
| EP-2010588-A1 | ORGANOSILICON-POLYUREA BASE POLYMER, ELASTOMER PREPARED THEREFROM, PREPARATION THEREOF AND USE OF THE SAME | Henkel AG & Co. KGaA (DE) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007118880-A1 | ORGANOSILICON-POLYUREA BASE POLYMER, ELASTOMER PREPARED THEREFROM, PREPARATION THEREOF AND USE OF THE SAME | HENKEL AG & CO. KGAA (DE) | 2007-10-25 | — | — | WO | disclosed |