⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3883667 | 0.86 | — | — | |
| SCHEMBL3883409 | 0.84 | — | — | |
| SCHEMBL3879205 | 0.77 | — | — | |
| SCHEMBL3876585 | 0.71 | — | — | |
| SCHEMBL2992709 | 0.70 | SPHK1 (0.50) | — | |
| SCHEMBL2988608 | 0.70 | SPHK1 (0.50) | — | |
| SCHEMBL2981074 | 0.70 | SPHK1 (0.50) | — | |
| SCHEMBL2994688 | 0.70 | SPHK1 (0.50) | — | |
| SCHEMBL15346771 | 0.70 | SPHK1 (0.50) | — | |
| SCHEMBL27965038 | 0.69 | HSD17B10 (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2124544-A1 | HYDROLYSIS RESISTANT ORGANOMODIFIED SILYLATED IONIC SURFACTANTS | Momentive Performance Materials Inc. (US) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008073396-A1 | HYDROLYSIS RESISTANT ORGANOMODIFIED SILYLATED IONIC SURFACTANTS | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2008-06-19 | — | — | WO | disclosed |