⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5958240 | 0.69 | — | — | |
| SCHEMBL9130128 | 0.62 | — | — | |
| N-Nitrosodiethylamine SCHEMBL106629 | 0.61 | — | — | |
| SCHEMBL5958237 | 0.61 | — | — | |
| SCHEMBL8910054 | 0.56 | — | — | |
| SCHEMBL5419127 | 0.56 | — | — | |
| SCHEMBL31301155 | 0.56 | — | — | |
| SCHEMBL64854 | 0.56 | — | — | |
| SCHEMBL22809109 | 0.54 | — | — | |
| N,N-Dimethylethanaminium SCHEMBL8763167 | 0.53 | — | — |
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-20050203045-A1 | Antisense modulation of cellular inhibitor of Apoptosis-2 expression | BENNETT C F (US) | 2005-09-15 | — | — | US | disclosed |
| WO-2002010409-A1 | ANTISENSE INHIBITION OF HER-3 EXPRESSION | ISIS PHARMACEUTICALS, INC. (US) | 2002-02-07 | — | — | WO | disclosed |