⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22276788 | 0.68 | — | — | |
| SCHEMBL12439405 | 0.62 | — | — | |
| SCHEMBL14215578 | 0.62 | — | — | |
| SCHEMBL2320506 | 0.62 | — | — | |
| SCHEMBL27151536 | 0.58 | — | — | |
| SCHEMBL27151528 | 0.58 | — | — | |
| SCHEMBL27151492 | 0.58 | — | — | |
| SCHEMBL13271222 | 0.57 | — | — | |
| SCHEMBL27151382 | 0.56 | — | — | |
| SCHEMBL27151380 | 0.56 | — | — |
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-3054981-B1 | PROTECTING GROUP COMPRISING A PURIFICATION TAG | ASCENDIS PHARMA AS (DK) | 2020-07-29 | — | — | EP | disclosed |
| EP-1731512-B9 | ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND NOXIOUS ORGANISM CONTROL AGENT | NISSAN CHEMICAL IND LTD (JP) | 2017-03-01 | — | — | EP | disclosed |