⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3305321 | 0.86 | — | — | |
| SCHEMBL2067090 | 0.84 | — | — | |
| SCHEMBL2067085 | 0.84 | — | — | |
| SCHEMBL5259874 | 0.81 | — | — | |
| SCHEMBL5259871 | 0.81 | — | — | |
| SCHEMBL5259878 | 0.81 | — | — | |
| SCHEMBL1360543 | 0.79 | — | — | |
| SCHEMBL3300331 | 0.79 | — | — | |
| SCHEMBL2065994 | 0.78 | — | — | |
| SCHEMBL5187036 | 0.78 | — | — |
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-20100092443-A1 | NOVEL COMBINATIONS OF NITROGENATED HETEROCYCLIC ANTIBACTERIAL COMPOUNDS WITH OTHER ANTIBACTERIAL COMPOUNDS AND THE USE OF SAME AS DRUGS | NOVEXEL (FR) | 2010-04-15 | — | — | US | claimed |
| US-20100092443-A1 | NOVEL COMBINATIONS OF NITROGENATED HETEROCYCLIC ANTIBACTERIAL COMPOUNDS WITH OTHER ANTIBACTERIAL COMPOUNDS AND THE USE OF SAME AS DRUGS | NOVEXEL (FR) | 2010-04-15 | — | — | US | disclosed |