⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8661024 | 0.87 | ALDH1A1 (0.31) | — | |
| SCHEMBL27939600 | 0.86 | — | — | |
| SCHEMBL27697057 | 0.84 | — | — | |
| SCHEMBL28024035 | 0.84 | CES1 (0.37) | — | |
| SCHEMBL30996901 | 0.83 | HPRT1 (0.48) | — | |
| SCHEMBL3414799 | 0.83 | HPRT1 (0.48) | — | |
| SCHEMBL30329701 | 0.82 | HPRT1 (0.47) | — | |
| SCHEMBL8661953 | 0.82 | — | — | |
| Ethane SCHEMBL27321160 | 0.80 | HPRT1 (0.45) | — | |
| SCHEMBL28795740 | 0.79 | — | — |
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-103613489-B | Dicyclo pentane is [cd, lm] perylene-1,2,7,8-tetraketone, preparation method and application also | NANJING UNIVERSITY OF INFORMATION SCIENCE AND TECHNOLOGY (CN) | 2015-10-21 | — | — | CN | disclosed |