⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8383945 | 0.84 | — | — | |
| SCHEMBL450275 | 0.78 | — | — | |
| SCHEMBL9744926 | 0.77 | — | — | |
| SCHEMBL8977871 | 0.72 | THRB (0.32) | — | |
| SCHEMBL669549 | 0.72 | — | — | |
| SCHEMBL17451260 | 0.71 | — | — | |
| SCHEMBL7805096 | 0.70 | — | — | |
| SCHEMBL14938344 | 0.70 | ALDH1A1 (0.32) | — | |
| SCHEMBL7786101 | 0.70 | — | — | |
| SCHEMBL6064302 | 0.70 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130120485-A1 | LIQUID APPLICATION DEVICE, LIQUID APPLICATION METHOD, AND NANOIMPRINT SYSTEM | FUJIFILM CORPORATION (JP) | 2013-05-16 | — | — | US | disclosed |