⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2697686 | 0.89 | — | — | |
| SCHEMBL2725116 | 0.88 | MAPT (0.36) | — | |
| SCHEMBL2725119 | 0.88 | MAPT (0.36) | — | |
| SCHEMBL2695735 | 0.87 | — | — | |
| SCHEMBL2695484 | 0.87 | — | — | |
| SCHEMBL2695721 | 0.86 | — | — | |
| SCHEMBL17103823 | 0.80 | ALDH1A1 (0.38) | — | |
| SCHEMBL17103822 | 0.80 | ALDH1A1 (0.38) | — | |
| SCHEMBL2696215 | 0.79 | P2RX3 (0.31) | — | |
| SCHEMBL17103857 | 0.78 | LIPE (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2635560-B1 | DIHYDROOXAZOL-2-AMINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2015-09-30 | — | — | EP | disclosed |
| US-8673950-B2 | Dihydrooxazol-2-amine derivatives | HOFFMANN-LAROCHE INC. (US) | 2014-03-18 | — | — | US | disclosed |
| US-20130345241-A1 | DIHYDROOXAZOL-2-AMINE DERIVATIVES | HOFFMANN-LA ROCHE INC. (US) | 2013-12-26 | — | — | US | disclosed |
| US-20120108609-A1 | DIHYDROOXAZOL-2-AMINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2012-05-03 | — | — | US | disclosed |