⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL153237 | 0.73 | — | — | |
| SCHEMBL29235908 | 0.73 | — | — | |
| SCHEMBL28351953 | 0.73 | — | — | |
| SCHEMBL22176862 | 0.73 | ALDH1A1 (0.36) | — | |
| SCHEMBL1867172 | 0.71 | KDM4E (0.39) | — | |
| Hydrochloric Acid SCHEMBL11770579 | 0.71 | — | — | |
| SCHEMBL18833596 | 0.71 | — | — | |
| SCHEMBL1378607 | 0.71 | — | — | |
| SCHEMBL10895248 | 0.71 | XPO1 (0.34) | — | |
| Acetic Acid SCHEMBL27750264 | 0.69 | KDM7A (0.44) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7919623-B2 | Naphthyridine derivatives having inhibitory activity against HIV integrase | SHIONOGI & CO., LTD. (JP) | 2011-04-05 | — | — | US | disclosed |
| US-7919623-B2 | Naphthyridine derivatives having inhibitory activity against HIV integrase | SHIONOGI & CO., LTD. (JP) | 2011-04-05 | — | — | US | disclosed |
| US-20090227621-A1 | Naphthyridine derivatives having inhibitory activity against hiv integrase | SHIONOGI & CO., LTD. (JP) | 2009-09-10 | — | — | US | disclosed |
| US-20090227621-A1 | Naphthyridine derivatives having inhibitory activity against hiv integrase | SHIONOGI & CO., LTD. (JP) | 2009-09-10 | — | — | US | disclosed |
| EP-0796241-B1 | COMPOUNDS AND METHODS FOR MONOSACCHARIDE ANALYSIS | BENDIAK BRAD K (US) | 2000-04-05 | — | — | EP | disclosed |
| EP-0796241-A2 | COMPOUNDS AND METHODS FOR MONOSACCHARIDE ANALYSIS | Bendiak, Brad K. (US) | 1997-09-24 | — | — | EP | disclosed |
| US-5585473-A | Compounds and methods for monosaccharide analysis | THE BIOMEMBRANE INSTITUTE (US) | 1996-12-17 | — | — | US | disclosed |
| WO-1996017824-A2 | COMPOUNDS AND METHODS FOR MONOSACCHARIDE ANALYSIS | BIOMEMBRANE INST (US) | 1996-06-13 | — | — | WO | disclosed |
| US-3931268-A | Methylhydrazinomethyl-substituted benzoic acid amides | HOFFMANN-LA ROCHE INC. (US) | 1976-01-06 | — | — | US | disclosed |