⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL202629 | 0.90 | — | — | |
| Hydrochloric Acid SCHEMBL3249862 | 0.87 | — | — | |
| SCHEMBL21359649 | 0.82 | — | — | |
| SCHEMBL23777897 | 0.81 | LMNA (0.31) | — | |
| SCHEMBL23120324 | 0.79 | CYP1A2 (0.31) | — | |
| SCHEMBL2552779 | 0.78 | — | — | |
| SCHEMBL24585263 | 0.78 | — | — | |
| SCHEMBL6246306 | 0.77 | — | — | |
| SCHEMBL6246314 | 0.77 | — | — | |
| Methyl Alcohol SCHEMBL9412777 | 0.76 | CYP1A2 (0.35) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3790630-A1 | AGENT FOR DYEING HAIR, CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A COLORING COMPOUND AND A FILM-FORMING, HYDROPHILIC POLYMER | Henkel AG & Co. KGaA (DE) | 2021-03-17 | — | — | EP | claimed |
| WO-2019214871-A1 | AGENT FOR DYEING HAIR, CONTAINING AT LEAST ONE ORGANIC SILICON COMPOUND, A COLORING COMPOUND AND A FILM-FORMING, HYDROPHILIC POLYMER | HENKEL AG & CO. KGAA (DE) | 2019-11-14 | — | — | WO | claimed |
| EP-3999189-A1 | METHOD FOR DYEING KERATINOUS MATERIAL, COMPRISING THE USE OF AN ORGANOSILICON COMPOUND, A COLORED EFFECT PIGMENT AND A FILM-FORMING POLYMER II | Henkel AG & Co. KGaA (DE) | 2022-05-25 | — | — | EP | disclosed |
| EP-3873405-A1 | BIS(TRIETHOXYSILYLPROPYL)AMINES COMBINED WITH AN ACID | Henkel AG & Co. KGaA (DE) | 2021-09-08 | — | — | EP | disclosed |
| WO-2021052720-A1 | METHOD FOR DYEING KERATINOUS MATERIAL, COMPRISING THE USE OF AN ORGANOSILICON COMPOUND, AN EFFECT PIGMENT AND A FILM-FORMING POLYMER | HENKEL AG & CO. KGAA (DE) | 2021-03-25 | — | — | WO | disclosed |
| WO-2021013509-A1 | METHOD FOR DYEING KERATINOUS MATERIAL, COMPRISING THE USE OF AN ORGANOSILICON COMPOUND, A COLORED EFFECT PIGMENT AND A FILM-FORMING POLYMER II | HENKEL AG & CO. KGAA (DE) | 2021-01-28 | — | — | WO | disclosed |