⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2466 | 0.95 | — | — | |
| SCHEMBL7161927 | 0.90 | — | — | |
| SCHEMBL28713638 | 0.90 | — | — | |
| Water SCHEMBL28654006 | 0.90 | — | — | |
| SCHEMBL2835967 | 0.90 | — | — | |
| SCHEMBL7745891 | 0.90 | — | — | |
| SCHEMBL8627911 | 0.90 | — | — | |
| SCHEMBL10580772 | 0.90 | — | — | |
| SCHEMBL5456193 | 0.90 | — | — | |
| SCHEMBL19810558 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030180445-A1 | Method for forming a catalytic bead sensor | INDUSTRIAL SCIENTIFIC CORPORATION | 2003-09-25 | — | — | US | claimed |
| US-20030180445-A1 | Method for forming a catalytic bead sensor | INDUSTRIAL SCIENTIFIC CORPORATION | 2003-09-25 | — | — | US | disclosed |