⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8957763 | 0.74 | — | — | |
| SCHEMBL7907300 | 0.67 | — | — | |
| SCHEMBL4020054 | 0.67 | — | — | |
| SCHEMBL7618643 | 0.61 | — | — | |
| SCHEMBL1542042 | 0.59 | LMNA (0.35) | — | |
| SCHEMBL2805724 | 0.59 | — | — | |
| SCHEMBL20548659 | 0.58 | — | — | |
| SCHEMBL2369959 | 0.57 | LMNA (0.40) | — | |
| SCHEMBL15786607 | 0.56 | — | — | |
| SCHEMBL15546171 | 0.54 | LMNA (0.30) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150105560-A1 | FORMULATION COMPRISING IONIC ORGANIC COMPOUNDS FOR USE IN ELECTRON TRANSPORT LAYERS | MERCK PATENT GMBH (DE) | 2015-04-16 | — | — | US | disclosed |