⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12800153 | 0.74 | — | — | |
| SCHEMBL27413506 | 0.70 | — | — | |
| SCHEMBL3192009 | 0.70 | — | — | |
| SCHEMBL21657714 | 0.70 | — | — | |
| SCHEMBL5540786 | 0.70 | — | — | |
| SCHEMBL9398202 | 0.70 | — | — | |
| SCHEMBL14481078 | 0.59 | — | — | |
| SCHEMBL241558 | 0.59 | — | — | |
| SCHEMBL753740 | 0.59 | — | — | |
| SCHEMBL116832 | 0.56 | — | — |
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-7368585-B2 | Synthetic techniques and intermediates for polyhydroxy dienyl lactones and mimics thereof | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2008-05-06 | — | — | US | disclosed |