⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL820016 | 1.00 | — | — | |
| SCHEMBL20593970 | 0.81 | CES1 (0.43) | — | |
| SCHEMBL28762619 | 0.80 | — | — | |
| SCHEMBL3084845 | 0.80 | — | — | |
| SCHEMBL15626616 | 0.78 | — | — | |
| SCHEMBL15314542 | 0.78 | — | — | |
| SCHEMBL6510174 | 0.78 | — | — | |
| SCHEMBL11536234 | 0.78 | — | — | |
| SCHEMBL28665980 | 0.78 | ACE2 (0.39) | — | |
| SCHEMBL29060866 | 0.77 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1930332-B1 | LUMINESCENT VARGULA LUCIFERIN SUBSTRATE AND PROCESS FOR PRODUCING THE SAME | NAT INST OF ADVANCED IND SCIEN (JP) | 2015-06-03 | — | — | EP | disclosed |
| US-8343729-B2 | Luciferin luminescent substrate of marine ostracod crustacean and method for production thereof | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2013-01-01 | — | — | US | disclosed |
| US-8343729-B2 | Luciferin luminescent substrate of marine ostracod crustacean and method for production thereof | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2013-01-01 | — | — | US | disclosed |
| US-20110287459-A1 | Luciferin luminescent substrate of marine ostracod crustacean and method for production thereof | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2011-11-24 | — | — | US | disclosed |
| US-20110287459-A1 | Luciferin luminescent substrate of marine ostracod crustacean and method for production thereof | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2011-11-24 | — | — | US | disclosed |
| US-7989621-B2 | Method for producing substituted imidazo[1,2-A]pyrazines of (s)-1-(3-(2-sec-butyl-6-(1h-indol-3-yl)-3-oxo-3,7-dihydroimadazo[1,2-a]pyrazin-8-yl)propyl)guanidine | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2011-08-02 | — | — | US | disclosed |
| US-20090136974-A1 | Luciferin Luminescent Substrate of Marine Ostracod Crustacean and Method for Production Thereof | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE TECHNOLOGY (JP) | 2009-05-28 | — | — | US | disclosed |