⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14500934 | 0.86 | — | — | |
| SCHEMBL14500944 | 0.86 | — | — | |
| SCHEMBL7042247 | 0.78 | — | — | |
| SCHEMBL7949889 | 0.78 | — | — | |
| SCHEMBL13623322 | 0.77 | — | — | |
| SCHEMBL22127722 | 0.77 | — | — | |
| SCHEMBL30288219 | 0.77 | — | — | |
| SCHEMBL1907284 | 0.75 | — | — | |
| SCHEMBL8938116 | 0.75 | — | — | |
| SCHEMBL4396424 | 0.75 | — | — |
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-7615526-B2 | Furanoid and pyranoid C14-C18- oxabicycloalkanones as odoriferous and/or aroma substances | SYMRISE GMBH & CO. KG (DE) | 2009-11-10 | — | — | US | disclosed |
| US-20080234174-A1 | FURANOID AND PYRANOID C14-C18- OXABICYCLOALKANONES AS ODORIFEROUS AND/OR AROMA SUBSTANCES | SYMRISE GMBH & CO. KG (DE) | 2008-09-25 | — | — | US | disclosed |