⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4434349 | 0.73 | — | — | |
| SCHEMBL27888971 | 0.64 | — | — | |
| SCHEMBL9719756 | 0.64 | — | — | |
| SCHEMBL4439509 | 0.62 | — | — | |
| SCHEMBL7484712 | 0.61 | ALDH1A1 (0.33) | — | |
| SCHEMBL5398586 | 0.61 | — | — | |
| SCHEMBL5388457 | 0.61 | — | — | |
| SCHEMBL17784243 | 0.61 | — | — | |
| SCHEMBL9356801 | 0.61 | — | — | |
| SCHEMBL9482472 | 0.61 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7491784-B2 | reacting phosphonic ester-functionalized alkoxysilane with a silanol-functional organosilicon compound; high yield and purity products, having higher stability as emulsions in water | WACKER CHEMIE AG (DE) | 2009-02-17 | — | — | US | disclosed |
| US-20070167597-A1 | Method for the production of organosiloxanes modified by a phosponic acid ester | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 2007-07-19 | — | — | US | disclosed |
| US-20060247409-A1 | Novel organosilicon compounds and a method for their production | CONSORTIUM FUER ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 2006-11-02 | — | — | US | disclosed |