⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL875190 | 1.00 | — | — | |
| SCHEMBL875192 | 1.00 | — | — | |
| SCHEMBL883513 | 0.93 | PDK2 (0.31) | — | |
| SCHEMBL875448 | 0.91 | ITGB1 (0.31) | — | |
| SCHEMBL875446 | 0.91 | ITGB1 (0.31) | — | |
| SCHEMBL875447 | 0.91 | ITGB1 (0.31) | — | |
| SCHEMBL876045 | 0.90 | PDK2 (0.33) | — | |
| SCHEMBL876046 | 0.90 | PDK2 (0.33) | — | |
| SCHEMBL876047 | 0.90 | PDK2 (0.33) | — | |
| SCHEMBL12503967 | 0.90 | HPGD (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2619189-A1 | ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS | Zoetis LLC (US) | 2013-07-31 | — | — | EP | disclosed |
| WO-2012038851-A1 | ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS | PFIZER INC. (US) | 2012-03-29 | — | — | WO | disclosed |