⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13464191 | 1.00 | — | — | |
| SCHEMBL19624786 | 0.69 | — | — | |
| SCHEMBL258990 | 0.59 | — | — | |
| SCHEMBL7516994 | 0.59 | — | — | |
| SCHEMBL3668329 | 0.56 | — | — | |
| Propylene Oxide SCHEMBL65104 | 0.56 | — | — | |
| Propylene Oxide SCHEMBL3957 | 0.56 | — | — | |
| SCHEMBL16449832 | 0.56 | — | — | |
| SCHEMBL2232125 | 0.56 | — | — | |
| SCHEMBL4109736 | 0.56 | — | — |
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-8623873-B2 | Substituted piperazines as CB1 antagonists | INTERVET INC. (US) | 2014-01-07 | — | — | US | disclosed |
| EP-2455375-A2 | Diacylhydrazine ligands for modulating the expression of exogenous genes in mammalian systems via an ecdysone receptor complex | Intrexon Corporation (US) | 2012-05-23 | — | — | EP | disclosed |