⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26125 | 0.77 | — | — | |
| SCHEMBL8671155 | 0.74 | — | — | |
| SCHEMBL28880874 | 0.74 | — | — | |
| SCHEMBL17085773 | 0.74 | — | — | |
| Methyl Alcohol SCHEMBL11792159 | 0.74 | FFAR3 (0.32) | — | |
| SCHEMBL727564 | 0.74 | — | — | |
| SCHEMBL2203521 | 0.70 | — | — | |
| SCHEMBL231940 | 0.70 | — | — | |
| SCHEMBL21049923 | 0.69 | — | — | |
| SCHEMBL8648831 | 0.69 | — | — |
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-7438830-B2 | Mixtures for producing transparent plastics, transparent plastics, method for producing the same and the use thereof | ROEHM GMBH & CO. KG (DE) | 2008-10-21 | — | — | US | disclosed |
| US-20080139771-A1 | Thio(Meth)Acrylates, Mixtures For Producing Transparent Plastics, Transparent Plastics And Method For Their Production And Use | ROEHM GMBH (DE) | 2008-06-12 | — | — | US | disclosed |
| US-20070161766-A1 | Mixtures for producing transparent plastics, transparent plastics, method for producing the same and the use thereof | ROEHM GMBH & CO. KG (DE) | 2007-07-12 | — | — | US | disclosed |