⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22869911 | 1.00 | — | — | |
| SCHEMBL28666747 | 1.00 | — | — | |
| SCHEMBL22870046 | 1.00 | — | — | |
| SCHEMBL14157194 | 0.82 | — | — | |
| SCHEMBL13763272 | 0.81 | — | — | |
| SCHEMBL19456295 | 0.81 | — | — | |
| SCHEMBL2118139 | 0.81 | — | — | |
| SCHEMBL14932881 | 0.81 | — | — | |
| SCHEMBL28136519 | 0.79 | THRB (0.35) | — | |
| SCHEMBL2072178 | 0.76 | CYP2C9 (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115232057-A | Synthesis method of gliclazide intermediate 3-azabicyclo [3.3.0] octane | 上海巽田科技股份有限公司 | 2022-10-25 | — | — | CN | claimed |
| CN-115232057-A | Synthesis method of gliclazide intermediate 3-azabicyclo [3.3.0] octane | 上海巽田科技股份有限公司 | 2022-10-25 | — | — | CN | disclosed |
| WO-2021000242-A1 | THIENOPYRIMIDINE DERIVATIVES HAVING STEREO CONFIGURATIONS AND USE THEREOF IN MEDICINE | 广东东阳光药业有限公司 | 2021-01-07 | — | — | WO | disclosed |