⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10861516 | 0.73 | — | — | |
| SCHEMBL11360106 | 0.69 | CYP1A2 (0.34) | — | |
| SCHEMBL19863567 | 0.69 | — | — | |
| SCHEMBL593712 | 0.67 | — | — | |
| SCHEMBL3236204 | 0.66 | — | — | |
| Acetic Acid SCHEMBL7110784 | 0.65 | — | — | |
| SCHEMBL22761836 | 0.64 | L3MBTL1 (0.32) | — | |
| SCHEMBL7993890 | 0.64 | L3MBTL1 (0.33) | — | |
| SCHEMBL7991918 | 0.64 | L3MBTL1 (0.33) | — | |
| SCHEMBL10935435 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005087755-A1 | PROCESSES FOR HIGHLY ENANTIO-AND DIASTEREOSELECTIVE SYNTHESIS OF ACYCLIC EPOXY ALCOHOLS AND ALLYLIC EPOXY ALCOHOLS | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2005-09-22 | — | — | WO | disclosed |