⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19244645 | 0.75 | — | — | |
| SCHEMBL3157250 | 0.75 | — | — | |
| SCHEMBL14838176 | 0.73 | — | — | |
| SCHEMBL7561696 | 0.71 | — | — | |
| SCHEMBL19089927 | 0.71 | — | — | |
| SCHEMBL15735088 | 0.67 | — | — | |
| SCHEMBL28953688 | 0.67 | ACHE (0.35) | — | |
| SCHEMBL15734838 | 0.67 | — | — | |
| SCHEMBL16948124 | 0.66 | — | — | |
| SCHEMBL231689 | 0.63 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6586599-B1 | Formating carbon-carbon bonds between carbocyclic halogen and organosilicon compounds in the presence of coordination catalysts, nitrogen compounds and bases; efficiency; catalysis | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION | 2003-07-01 | — | — | US | claimed |
| WO-2001066248-A2 | C-C AND C-N COUPLING CATALYST COMPRISING TRANSITION METAL AND CARBENE | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION (US) | 2001-09-13 | — | — | WO | claimed |
| US-6586599-B1 | Formating carbon-carbon bonds between carbocyclic halogen and organosilicon compounds in the presence of coordination catalysts, nitrogen compounds and bases; efficiency; catalysis | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION | 2003-07-01 | — | — | US | disclosed |
| WO-2001066248-A2 | C-C AND C-N COUPLING CATALYST COMPRISING TRANSITION METAL AND CARBENE | UNIVERSITY OF NEW ORLEANS RESEARCH AND TECHNOLOGY FOUNDATION (US) | 2001-09-13 | — | — | WO | disclosed |