⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6357830 | 1.00 | — | — | |
| SCHEMBL8699893 | 0.83 | — | — | |
| SCHEMBL8699896 | 0.83 | — | — | |
| SCHEMBL8700010 | 0.81 | EP300 (0.45) | — | |
| SCHEMBL8700013 | 0.81 | EP300 (0.45) | — | |
| SCHEMBL28080884 | 0.78 | — | — | |
| SCHEMBL10399859 | 0.75 | — | — | |
| SCHEMBL10399857 | 0.75 | — | — | |
| SCHEMBL23112800 | 0.74 | — | — | |
| SCHEMBL6565801 | 0.74 | TSHR (0.30) | — |
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-110256427-B | 2- (morpholin-4-yl) -1, 7-naphthyridine | 拜耳制药股份公司 | 2022-02-22 | — | — | CN | disclosed |
| CN-112126274-A | Photocurable composition for PCB containing alkenyl ether and/or oxetane compound | 四川乐凯新材料有限公司 | 2020-12-25 | — | — | CN | disclosed |
| US-20050032182-A1 | Process for the enantioselective preparation of secondary alcohols by lipase-catalyzed solvolysis of the corresponding acetoacetic esters | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH | 2005-02-10 | — | — | US | disclosed |