⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27730293 | 0.80 | — | — | |
| SCHEMBL8077676 | 0.79 | ALDH1A1 (0.56) | — | |
| SCHEMBL6250392 | 0.79 | ALDH1A1 (0.56) | — | |
| Methyl Alcohol SCHEMBL27732418 | 0.78 | — | — | |
| Acetone SCHEMBL27929595 | 0.76 | LMNA (0.43) | — | |
| Ethylene SCHEMBL27823002 | 0.73 | — | — | |
| Acetic Acid SCHEMBL27640863 | 0.73 | FFAR3 (0.47) | — | |
| SCHEMBL21859 | 0.73 | — | — | |
| SCHEMBL28754303 | 0.73 | — | — | |
| SCHEMBL1112353 | 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-108473521-A | Substituted cyclopentadienyl cobalt complex and its preparing method, cobalt-containing film and its preparing method | 东曹株式会社 | 2018-08-31 | — | — | CN | disclosed |