⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13992311 | 0.89 | — | — | |
| SCHEMBL18911589 | 0.77 | — | — | |
| 1,2-Dibromoethane SCHEMBL1448860 | 0.76 | — | — | |
| SCHEMBL13916487 | 0.71 | — | — | |
| Dibromomethane SCHEMBL20701 | 0.68 | — | — | |
| SCHEMBL3761033 | 0.67 | — | — | |
| SCHEMBL2289057 | 0.67 | — | — | |
| 2-Bromoethanol SCHEMBL13916048 | 0.63 | — | — | |
| Bromoethanamine SCHEMBL12391152 | 0.63 | — | — | |
| SCHEMBL18806904 | 0.59 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090209550-A1 | SUBSTITUTED TRIAZOLOPYRIDINES | AUSPEX PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | US | disclosed |
| US-20090209550-A1 | SUBSTITUTED TRIAZOLOPYRIDINES | AUSPEX PHARMACEUTICALS, INC. (US) | 2009-08-20 | — | — | US | disclosed |
| US-20090062182-A1 | DEUTERIUM-ENRICHED DALBAVANCIN | PROTIA, LLC (US) | 2009-03-05 | — | — | US | disclosed |