⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL79871 | 0.75 | — | — | |
| SCHEMBL10950739 | 0.75 | FDPS (0.32) | — | |
| SCHEMBL2086452 | 0.75 | DGAT1 (0.31) | — | |
| SCHEMBL13461209 | 0.75 | — | — | |
| SCHEMBL14962814 | 0.73 | — | — | |
| SCHEMBL8279446 | 0.73 | — | — | |
| SCHEMBL7699214 | 0.73 | — | — | |
| SCHEMBL8119240 | 0.73 | — | — | |
| SCHEMBL22972244 | 0.71 | — | — | |
| SCHEMBL13485473 | 0.71 | — | — |
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-7612059-B2 | Pyrrolidine bicyclic compounds and its derivatives, compositions and methods of use | VICURON PHARMACEUTICALS, INC. (US) | 2009-11-03 | — | — | US | disclosed |