⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27899768 | 0.89 | — | — | |
| SCHEMBL2471659 | 0.89 | — | — | |
| SCHEMBL28104261 | 0.80 | — | — | |
| SCHEMBL16653893 | 0.80 | — | — | |
| SCHEMBL6855999 | 0.80 | — | — | |
| SCHEMBL17002619 | 0.80 | — | — | |
| SCHEMBL1446765 | 0.78 | — | — | |
| SCHEMBL15456 | 0.78 | — | — | |
| SCHEMBL27491236 | 0.78 | — | — | |
| SCHEMBL14859456 | 0.73 | — | — |
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-104737344-B | Fuel cell and method for operating fuel cell | 住友电气工业株式会社 | 2017-10-31 | — | — | CN | disclosed |