⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL645100 | 0.93 | — | — | |
| SCHEMBL1567 | 0.93 | — | — | |
| SCHEMBL732100 | 0.86 | — | — | |
| Phosphine SCHEMBL11344163 | 0.86 | — | — | |
| SCHEMBL3648065 | 0.86 | — | — | |
| SCHEMBL331 | 0.86 | — | — | |
| Water SCHEMBL647336 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL1728007 | 0.86 | — | — | |
| SCHEMBL10535380 | 0.86 | — | — | |
| SCHEMBL4133917 | 0.86 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110284805-A1 | PRODUCTION OF MECHANICALLY EXFOLIATED GRAPHENE AND NANOPARTICLE COMPOSITES COMPRISING SAME | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-11-24 | — | — | US | claimed |
| US-20110284805-A1 | PRODUCTION OF MECHANICALLY EXFOLIATED GRAPHENE AND NANOPARTICLE COMPOSITES COMPRISING SAME | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2011-11-24 | — | — | US | disclosed |