⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3516745 | 1.00 | — | — | |
| SCHEMBL7039074 | 0.82 | FFAR3 (0.30) | — | |
| SCHEMBL7034669 | 0.82 | FFAR3 (0.30) | — | |
| SCHEMBL3516780 | 0.75 | — | — | |
| SCHEMBL9709114 | 0.75 | — | — | |
| SCHEMBL3516784 | 0.75 | — | — | |
| SCHEMBL3518968 | 0.75 | — | — | |
| SCHEMBL3514183 | 0.69 | — | — | |
| SCHEMBL3514188 | 0.69 | — | — | |
| SCHEMBL654433 | 0.68 | CHRM1 (0.36) | — |
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-8236917-B2 | Compound having silsesquioxane skeleton and its polymer | JNC CORPORATION (JP) | 2012-08-07 | — | — | US | disclosed |
| US-20100240855-A1 | Compound having silsesquioxane skeleton and its polymer | JNC CORPORATION (JP) | 2010-09-23 | — | — | US | disclosed |