⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18424874 | 1.00 | — | — | |
| SCHEMBL15400686 | 0.90 | — | — | |
| SCHEMBL28990128 | 0.87 | — | — | |
| SCHEMBL28593324 | 0.86 | — | — | |
| SCHEMBL400325 | 0.80 | — | — | |
| SCHEMBL26726948 | 0.79 | — | — | |
| SCHEMBL3673610 | 0.78 | — | — | |
| SCHEMBL1146454 | 0.78 | — | — | |
| SCHEMBL10001395 | 0.77 | — | — | |
| SCHEMBL14339797 | 0.77 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1213011-B1 | Cosmetic material comprising branched silicone compounds | SHINETSU CHEMICAL CO (JP) | 2016-02-17 | — | — | EP | disclosed |
| US-6790451-B2 | SILICONE-BRANCHED SILICONE COMPOUND AND A SILICONE-BRANCHED POLYETHER-MODIFIED SILICONE AS COSMETIC INGREDIENTS; HIGH STABILITY IN AN EMULSIFIED STATE AND HIGH TRANSPARENCY; FEELING OF REFRESHMENT FOR THE USER | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2004-09-14 | — | — | US | disclosed |
| US-20020114771-A1 | Cosmetic material | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-08-22 | — | — | US | disclosed |
| EP-1213011-A1 | Cosmetic material comprising branched silicone compounds | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-06-12 | — | — | EP | disclosed |