⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5139179 | 0.81 | GABRR1 (0.72) | — | |
| SCHEMBL8044370 | 0.80 | — | — | |
| SCHEMBL4572037 | 0.80 | — | — | |
| SCHEMBL12518152 | 0.80 | — | — | |
| SCHEMBL3916344 | 0.80 | — | — | |
| SCHEMBL25539318 | 0.76 | GABRR1 (0.48) | — | |
| SCHEMBL9434957 | 0.76 | GABRR1 (0.48) | — | |
| SCHEMBL10636472 | 0.75 | ACE2 (0.47) | — | |
| SCHEMBL15681452 | 0.75 | GABRR1 (0.46) | — | |
| SCHEMBL11846053 | 0.75 | BHMT (0.55) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1594912-B1 | SILICA GEL BONDED WITH CUCURBITURILS | POSTECH FOUNDATION (KR) | 2012-09-12 | — | — | EP | disclosed |
| US-7504029-B2 | Silica gel bonded with cucurbituril | POSTECH FOUNDATION (KR) | 2009-03-17 | — | — | US | disclosed |
| EP-1594912-A4 | SILICA GEL BONDED WITH CUCURBITURILS | POSTECH FOUNDATION (KR) | 2007-05-30 | — | — | EP | disclosed |
| US-20060207938-A1 | Silica gel bonded with cucurbituril | POSTECH FOUNDATION (KR) | 2006-09-21 | — | — | US | disclosed |
| EP-1594912-A1 | SILICA GEL BONDED WITH CUCURBITURILS | Postech Foundation (KR) | 2005-11-16 | — | — | EP | disclosed |
| WO-2004072151-A1 | SILICA GEL BONDED WITH CUCURBITURILS | POSTECH FOUNDATION (KR) | 2004-08-26 | — | — | WO | disclosed |