⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6308136 | 0.82 | — | — | |
| SCHEMBL7995134 | 0.75 | ACHE (0.32) | — | |
| SCHEMBL5705417 | 0.62 | — | — | |
| SCHEMBL16785663 | 0.61 | ACHE (0.38) | — | |
| SCHEMBL14217694 | 0.61 | ACHE (0.38) | — | |
| SCHEMBL2063051 | 0.60 | ALDH1A1 (0.44) | — | |
| SCHEMBL2495732 | 0.59 | ACHE (0.36) | — | |
| SCHEMBL2494937 | 0.59 | ACHE (0.36) | — | |
| SCHEMBL17627687 | 0.59 | — | — | |
| SCHEMBL4780395 | 0.58 | ALDH1A1 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1519189-A1 | METHOD OF ANALYZING PROBE SUPPORT BY USING FLYING TIME SECONDARY ION MASS SPECTROMETRY | CANON KABUSHIKI KAISHA (JP) | 2005-03-30 | — | — | EP | disclosed |
| US-20040137491-A1 | Method of analyzing probe carrier using time-of-flight secondary ion mass spectrometry | CANON KABUSHIKI KAISHA (JP) | 2004-07-15 | — | — | US | disclosed |