⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8439092 | 0.81 | — | — | |
| SCHEMBL1132484 | 0.81 | — | — | |
| SCHEMBL25883306 | 0.78 | — | — | |
| SCHEMBL3634009 | 0.78 | — | — | |
| SCHEMBL6370992 | 0.78 | — | — | |
| SCHEMBL7547599 | 0.77 | — | — | |
| SCHEMBL16377855 | 0.77 | — | — | |
| SCHEMBL30351081 | 0.77 | — | — | |
| SCHEMBL9541702 | 0.75 | — | — | |
| SCHEMBL27336635 | 0.74 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2158242-B1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | DORF KETAL CHEMICALS INDIA PRIVATE LTD (IN) | 2019-12-25 | — | — | EP | disclosed |
| US-20100292449-A1 | WATER-STABLE COMPOUNDS, CATALYSTS AND CATALYSED REACTIONS | JOHNSON MATTHEY PLC (GB) | 2010-11-18 | — | — | US | disclosed |
| EP-2162213-A1 | WATER-STABLE COMPOUNDS, CATALYSTS AND CATALYSED REACTIONS | Johnson Matthey PLC (GB) | 2010-03-17 | — | — | EP | disclosed |
| EP-2158242-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | Johnson Matthey PLC (GB) | 2010-03-03 | — | — | EP | disclosed |
| WO-2008155569-A1 | WATER-STABLE CATALYSTS FOR POLYURETHANE MANUFACTURE | JOHNSON MATTHEY PLC (GB) | 2008-12-24 | — | — | WO | disclosed |
| WO-2008155568-A1 | WATER-STABLE COMPOUNDS, CATALYSTS AND CATALYSED REACTIONS | JOHNSON MATTHEY PLC (GB) | 2008-12-24 | — | — | WO | disclosed |
| US-4963274-A | Concentrated fabric conditioners | HUELS AKTIENGESELLSCHAFT (DE) | 1990-10-16 | — | — | US | disclosed |
| EP-0295386-A2 | Concentrated fabric softener | HÜLS AKTIENGESELLSCHAFT (DE) | 1988-12-21 | — | — | EP | disclosed |