⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6741324 | 0.60 | — | — | |
| Methane SCHEMBL5691413 | 0.57 | — | — | |
| SCHEMBL2758552 | 0.53 | — | — | |
| SCHEMBL16270530 | 0.53 | — | — | |
| Sulfurous Acid SCHEMBL31465170 | 0.52 | — | — | |
| Sulfurous Acid SCHEMBL11519953 | 0.50 | — | — | |
| Ethane SCHEMBL27922892 | 0.49 | — | — | |
| SCHEMBL5566763 | 0.49 | — | — | |
| SCHEMBL2552774 | 0.49 | — | — | |
| SCHEMBL1561 | 0.49 | — | — |
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-2890686-B1 | METHOD FOR PRODUCING OXAZOLE COMPOUND | OTSUKA PHARMA CO LTD (JP) | 2017-01-04 | — | — | EP | disclosed |
| US-20160030244-A1 | SYSTEM AND APPARATUS FOR TREATING THE LENS OF AN EYE | LENSAR, INC. (US) | 2016-02-04 | — | — | US | disclosed |