⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6234860 | 0.85 | LMNA (0.35) | — | |
| SCHEMBL6231897 | 0.85 | LMNA (0.35) | — | |
| SCHEMBL180864 | 0.81 | CAMK2A (0.40) | — | |
| SCHEMBL9943523 | 0.79 | — | — | |
| SCHEMBL9478643 | 0.79 | TSHR (0.33) | — | |
| SCHEMBL9322126 | 0.79 | AKR1B1 (0.41) | — | |
| SCHEMBL10604994 | 0.77 | TSHR (0.52) | — | |
| SCHEMBL10803394 | 0.77 | AKR1B1 (0.44) | — | |
| SCHEMBL1286839 | 0.76 | LMNA (0.35) | — | |
| SCHEMBL11416491 | 0.76 | GPR84 (0.46) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1644527-B9 | CUCURBITURIL DERIVATIVE-BONDED SOLID SUBSTRATE AND BIOCHIP USING THE SAME | POSTECH FOUNDATION (KR) | 2012-01-04 | — | — | EP | disclosed |
| EP-1644527-B1 | CUCURBITURIL DERIVATIVE-BONDED SOLID SUBSTRATE AND BIOCHIP USING THE SAME | POSTECH FOUNDATION (KR) | 2011-03-09 | — | — | EP | disclosed |
| US-7867391-B2 | Cucurbituril derivative-bonded solid substrate and biochip using the same | POSTECH FOUNDATION (KR) | 2011-01-11 | — | — | US | disclosed |
| EP-1644527-A4 | CUCURBITURIL DERIVATIVE-BONDED SOLID SUBSTRATE AND BIOCHIP USING THE SAME | POSTECH FOUNDATION (KR) | 2008-05-21 | — | — | EP | disclosed |
| US-20060160207-A1 | Cucurbituril derivative-bonded solid substrate and biochip using the same | POSTECH FOUNDATION (KR) | 2006-07-20 | — | — | US | disclosed |
| EP-1644527-A1 | CUCURBITURIL DERIVATIVE-BONDED SOLID SUBSTRATE AND BIOCHIP USING THE SAME | Postech Foundation (KR) | 2006-04-12 | — | — | EP | disclosed |
| WO-2005003391-A1 | CUCURBITURIL DERIVATIVE-BONDED SOLID SUBSTRATE AND BIOCHIP USING THE SAME | POSTECH FOUNDATION (KR) | 2005-01-13 | — | — | WO | disclosed |