⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19629453 | 0.83 | NOTUM (0.41) | — | |
| SCHEMBL22022951 | 0.83 | PTGS2 (0.37) | — | |
| SCHEMBL19431490 | 0.75 | CYP2A6 (0.39) | — | |
| SCHEMBL20243067 | 0.74 | FAAH (0.34) | — | |
| SCHEMBL18879740 | 0.74 | NISCH (0.31) | — | |
| SCHEMBL18069699 | 0.73 | RAB9A (0.40) | — | |
| SCHEMBL18752323 | 0.70 | DYRK1A (0.41) | — | |
| SCHEMBL1755656 | 0.69 | ITGB2 (0.33) | — | |
| SCHEMBL12331338 | 0.67 | KDM4E (0.44) | — | |
| SCHEMBL6333758 | 0.65 | — | — |
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-10323142-B2 | Perfluoroelastomeric compositions comprising oxazoles | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2019-06-18 | — | — | US | disclosed |
| US-20180258271-A1 | Perfluoroelastomeric Compositions Comprising Oxazoles | 3M INNOVATIVE PROPERTIES COMPANY | 2018-09-13 | — | — | US | disclosed |
| EP-3303470-A1 | PERFLUOROELASTOMERIC COMPOSITIONS COMPRISING OXAZOLES | 3M Innovative Properties Company (US) | 2018-04-11 | — | — | EP | disclosed |
| WO-2016195900-A1 | PERFLUOROELASTOMERIC COMPOSITIONS COMPRISING OXAZOLES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2016-12-08 | — | — | WO | disclosed |