⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL75409 | 0.73 | LMNA (0.47) | — | |
| SCHEMBL1270185 | 0.73 | LMNA (0.47) | — | |
| SCHEMBL8581852 | 0.69 | — | — | |
| SCHEMBL15635306 | 0.69 | — | — | |
| SCHEMBL2050718 | 0.69 | — | — | |
| E968 SCHEMBL10427336 | 0.67 | — | — | |
| E968 SCHEMBL17062 | 0.67 | — | — | |
| E968 SCHEMBL6729753 | 0.67 | — | — | |
| E968 SCHEMBL121807 | 0.67 | — | — | |
| E968 SCHEMBL2723809 | 0.67 | LMNA (0.67) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6841550-B1 | Benzoxazine and benzothiazine derivatives and their use in medicines | SCHERING AKTIENGESELLSCHAFT (DE) | 2005-01-11 | — | — | US | disclosed |
| CN-1144794-C | Benzoxazine and benzothiazine derivatives and their use in medicine | ���ֹɷݹ�˾ | 2004-04-07 | — | — | CN | disclosed |
| CN-1319097-A | Benzoxazine and benzothiazine derivatives and their use in medicines | SCHERING AG (DE) | 2001-10-24 | — | — | CN | disclosed |