⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL125054 | 0.89 | — | — | |
| SCHEMBL6434860 | 0.89 | — | — | |
| Methane SCHEMBL1071936 | 0.89 | — | — | |
| Methane SCHEMBL7713958 | 0.89 | — | — | |
| SCHEMBL8969621 | 0.78 | — | — | |
| SCHEMBL18357 | 0.78 | — | — | |
| SCHEMBL397781 | 0.78 | — | — | |
| SCHEMBL2554735 | 0.78 | — | — | |
| Benzene SCHEMBL1901116 | 0.68 | — | — | |
| SCHEMBL1657682 | 0.67 | — | — |
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-8952118-B2 | Dual functional linear siloxanes, step-growth polymers derived therefrom, and methods of preparation thereof | GELEST TECHNOLOGIES, INC. (US) | 2015-02-10 | — | — | US | disclosed |
| US-20130041098-A1 | DUAL FUNCTIONAL LINEAR SILOXANES, STEP-GROWTH POLYMERS DERIVED THEREFROM, AND METHODS OF PREPARATION THEREOF | GELEST TECHNOLOGIES, INC. (US) | 2013-02-14 | — | — | US | disclosed |