⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL126608 | 1.00 | — | — | |
| SCHEMBL28170742 | 1.00 | — | — | |
| SCHEMBL30629015 | 1.00 | — | — | |
| SCHEMBL11086015 | 0.96 | — | — | |
| SCHEMBL27706047 | 0.96 | — | — | |
| SCHEMBL112392 | 0.87 | — | — | |
| Bicarbonate SCHEMBL7645241 | 0.84 | — | — | |
| SCHEMBL26292 | 0.82 | — | — | |
| SCHEMBL3144339 | 0.82 | — | — | |
| Formic Acid SCHEMBL27810970 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110770330-B | Lubricating oil composition | 出光兴产株式会社 | 2022-07-19 | — | — | CN | disclosed |