⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL231393 | 0.78 | — | — | |
| SCHEMBL11500860 | 0.77 | — | — | |
| SCHEMBL9986507 | 0.75 | — | — | |
| SCHEMBL11804302 | 0.72 | — | — | |
| Acetic Acid SCHEMBL4394142 | 0.69 | — | — | |
| Acetic Acid SCHEMBL1516463 | 0.69 | — | — | |
| SCHEMBL20451253 | 0.69 | — | — | |
| SCHEMBL7053324 | 0.69 | — | — | |
| Acetic Acid SCHEMBL2112596 | 0.68 | — | — | |
| SCHEMBL8913461 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2289975-B1 | Organopolysiloxane compound and amidoamine compound, and cosmetic preparation | SHINETSU CHEMICAL CO (JP) | 2012-08-22 | — | — | EP | disclosed |
| US-20110052523-A1 | ORGANOPOLYSILOXANE COMPOUND AND AMIDOAMINE COMPOUND, AND COSMETIC PREPARATION | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2011-03-03 | — | — | US | disclosed |
| EP-2289975-A2 | Organopolysiloxane compound and amidoamine compound, and cosmetic preparation | Shin-Etsu Chemical Co., Ltd. (JP) | 2011-03-02 | — | — | EP | disclosed |