⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11845265 | 0.74 | — | — | |
| SCHEMBL6559212 | 0.74 | — | — | |
| SCHEMBL27838226 | 0.74 | CES2 (0.50) | — | |
| SCHEMBL27617620 | 0.70 | — | — | |
| SCHEMBL9863688 | 0.70 | — | — | |
| SCHEMBL27328512 | 0.70 | HIF1A (0.36) | — | |
| SCHEMBL3628993 | 0.69 | — | — | |
| SCHEMBL6557522 | 0.69 | — | — | |
| SCHEMBL31038540 | 0.67 | — | — | |
| SCHEMBL11851526 | 0.65 | — | — |
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-103947017-B | Carbon-lead blends for use in hybrid energy storage devices | 巴斯福股份公司 | 2017-11-17 | — | — | CN | disclosed |