⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL500978 | 1.00 | — | — | |
| SCHEMBL9480172 | 0.73 | — | — | |
| SCHEMBL9480180 | 0.73 | — | — | |
| SCHEMBL1365395 | 0.71 | — | — | |
| SCHEMBL1365394 | 0.71 | — | — | |
| SCHEMBL6426443 | 0.71 | — | — | |
| SCHEMBL4632502 | 0.71 | — | — | |
| SCHEMBL4632500 | 0.71 | — | — | |
| SCHEMBL669050 | 0.69 | — | — | |
| SCHEMBL168758 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20080054171-A1 | Target for Laser Desorption/Ionisation Mass Spectrometry | PHYSIKALISCHES BURO STEINMULLER GMBH | 2008-03-06 | — | — | US | claimed |
| WO-2007030849-A1 | METHOD FOR DETECTING ORGANIC COMPOUNDS | Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) | 2007-03-22 | — | — | WO | claimed |
| US-8105513-B2 | Pipette tip containing particle-filled polymer monolith | BONN ALEXANDER (AT) | 2012-01-31 | — | — | US | disclosed |
| US-20100009845-A1 | Pipette Tip Containing Particle-Filled Polymer Monolith | BONN ALEXANDER | 2010-01-14 | — | — | US | disclosed |
| US-20080054171-A1 | Target for Laser Desorption/Ionisation Mass Spectrometry | PHYSIKALISCHES BURO STEINMULLER GMBH | 2008-03-06 | — | — | US | disclosed |
| WO-2007030849-A1 | METHOD FOR DETECTING ORGANIC COMPOUNDS | Austria Wirtschaftsservice Gesellschaft mit beschränkter Haftung (AT) | 2007-03-22 | — | — | WO | disclosed |
| US-4054569-A | CNS DEPRESSANTS, ANTICONVULSIVES, ANTIINFLAMMATORY | AYERST MCKENNA & HARRISON LTD. (CA) | 1977-10-18 | — | — | US | disclosed |