⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1133798 | 0.76 | — | — | |
| SCHEMBL4383876 | 0.73 | — | — | |
| SCHEMBL2985874 | 0.73 | — | — | |
| SCHEMBL3747066 | 0.73 | — | — | |
| SCHEMBL106122 | 0.73 | — | — | |
| SCHEMBL10076291 | 0.73 | — | — | |
| SCHEMBL27300726 | 0.73 | — | — | |
| SCHEMBL6168639 | 0.73 | — | — | |
| SCHEMBL13573726 | 0.72 | — | — | |
| SCHEMBL14160685 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7629415-B2 | Highly concentrated self-emulsifying preparations containing organopolysiloxanes and alkylammonium compounds and use thereof in aqueous systems | RUDOLF GMBH & CO. KG CHEMISCHE FABRIK (DE) | 2009-12-08 | — | — | US | disclosed |
| US-20070012895-A1 | Highly concentrated, self-emulsifying preparations containing organopolysiloxanes and alkyl ammonium compounds and their use in aqueous systems | RUDOLF GMBH & CO. KG CHEMISCHE FABRIK (DE) | 2007-01-18 | — | — | US | disclosed |