⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL568016 | 0.87 | — | — | |
| SCHEMBL28355531 | 0.75 | — | — | |
| SCHEMBL8580467 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL277256 | 0.75 | — | — | |
| Iodide SCHEMBL392480 | 0.75 | — | — | |
| SCHEMBL10869299 | 0.75 | — | — | |
| SCHEMBL28515209 | 0.75 | — | — | |
| SCHEMBL28355395 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL15863446 | 0.67 | — | — | |
| Ethane SCHEMBL4032873 | 0.58 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2115764-B1 | MASS SPECTROMETER | MICROMASS LTD (GB) | 2018-12-05 | — | — | EP | disclosed |
| EP-2159822-B1 | Mass spectrometer | MICROMASS LTD (GB) | 2014-04-30 | — | — | EP | disclosed |
| US-8552366-B2 | Mass spectrometer | MICROMASS UK LIMITED (GB) | 2013-10-08 | — | — | US | disclosed |
| US-20110168882-A1 | Mass Spectrometer | MICROMASS UK LIMITED (GB) | 2011-07-14 | — | — | US | disclosed |
| EP-2159822-A1 | Mass spectrometer | Micromass UK Limited (GB) | 2010-03-03 | — | — | EP | disclosed |
| EP-2115764-A2 | MASS SPECTROMETER | Micromass UK Limited (GB) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008104771-A2 | MASS SPECTROMETER | MICROMASS UK LIMITED (GB) | 2008-09-04 | — | — | WO | disclosed |
| US-4013887-A | METHODS AND APPARATUS FOR SPATIAL SEPARATION OF AC AND DC ELECTRIC FIELDS WITH APPLICATION TO FRINGE FIELDS IN QUADRUPOLE MASS FILTERS | WATERS INVESTMENTS LIMITED | 1977-03-22 | — | — | US | disclosed |