⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL181074 | 0.88 | — | — | |
| SCHEMBL28026975 | 0.83 | — | — | |
| SCHEMBL11018793 | 0.83 | — | — | |
| SCHEMBL7165138 | 0.83 | — | — | |
| SCHEMBL11869329 | 0.83 | — | — | |
| SCHEMBL37860 | 0.83 | — | — | |
| Water SCHEMBL28237488 | 0.83 | — | — | |
| SCHEMBL11344532 | 0.82 | — | — | |
| Nitrogen SCHEMBL28310288 | 0.82 | — | — | |
| SCHEMBL8038380 | 0.81 | KDM4E (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020027675-A1 | NON-METALLIC LUMINESCENT OXYGEN SENSORS FOR AIRCRAFT FUEL TANKS | INSTITUTO SUPERIOR TÉCNICO (PT) | 2020-02-06 | — | — | WO | disclosed |