⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13815779 | 0.71 | — | — | |
| SCHEMBL2029521 | 0.69 | — | — | |
| SCHEMBL11239417 | 0.69 | — | — | |
| SCHEMBL711387 | 0.67 | — | — | |
| SCHEMBL23748142 | 0.67 | — | — | |
| SCHEMBL891819 | 0.67 | — | — | |
| SCHEMBL2108809 | 0.67 | — | — | |
| SCHEMBL3923184 | 0.67 | — | — | |
| SCHEMBL2108806 | 0.67 | — | — | |
| SCHEMBL4492370 | 0.65 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8212132-B2 | fullerenes reacted with N,N-dimethylaminopyridine (DMAP) ( first nucleophile) and dimethyl acetylene-dicarboxylate (DMAD) (e.g., an alkyne) to produce substituted molecule, which can be further reacted with a second nucleophile to form substituted molecule; sensors, electrodes, photovoltic cells | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2012-07-03 | — | — | US | disclosed |
| EP-2132136-A2 | FUNCTIONALIZATION OF NANOSCALE ARTICLES INCLUDING NANOTUBES AND FULLERENES | Massachusetts Institute of Technology (US) | 2009-12-16 | — | — | EP | disclosed |
| WO-2008133779-A2 | FUNCTIONALIZATION OF NANOSCALE ARTICLES INCLUDING NANOTUBES AND FULLERENES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2008-11-06 | — | — | WO | disclosed |
| US-20080221240-A1 | FUNCTIONALIZATION OF NANOSCALE ARTICLES INCLUDING NANOTUBES AND FULLERENES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2008-09-11 | — | — | US | disclosed |
| EP-0062587-A1 | Hydrazine derivatives, their preparation and their application as fungicides and bactericides | HEXACHIMIE Société anonyme dite: (FR) | 1982-10-13 | — | — | EP | disclosed |