⚠ 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL28182965 | 0.97 | — | — | |
| SCHEMBL676896 | 0.97 | — | — | |
| SCHEMBL27871994 | 0.97 | — | — | |
| SCHEMBL429206 | 0.97 | — | — | |
| SCHEMBL477804 | 0.97 | — | — | |
| Fluoride SCHEMBL28322246 | 0.97 | — | — | |
| SCHEMBL2796248 | 0.97 | — | — | |
| SCHEMBL23751318 | 0.93 | — | — | |
| SCHEMBL8854394 | 0.93 | — | — | |
| Iodide SCHEMBL9441777 | 0.93 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8889839-B2 | Pyridine-bis (oxazoline)(“pybox”) moiety as a chelator and sensitizer for lanthanide ion (Ln (III)) Luminescence | SYRACUSE UNIVERSITY (US) | 2014-11-18 | — | — | US | disclosed |
| US-20090281290-A1 | Pyridine-bis (oxazoline)(\"pybox\") moiety as a chelator and sensitizer for lanthanide Ion (Ln (III)) luminescence | SYRACUSE UNIVERSITY (US) | 2009-11-12 | — | — | US | disclosed |
| US-4233216-A | INTERMEDIATES FOR OXADETHIACEPHALOSPORINS | SHIONOGI & CO., LTD. (JP) | 1980-11-11 | — | — | US | disclosed |
| US-4183855-A | INTERMEDIATES FOR PREPARATION OF THE BACTERICIDE, 1-OXADETHIA-CEPHALOSPORIN | SHIONOGI & CO., LTD. (JP) | 1980-01-15 | — | — | US | disclosed |