⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1038139 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL21855077 | 0.73 | — | — | |
| Cyclopropane SCHEMBL1078223 | 0.69 | — | — | |
| Cyclohexane SCHEMBL6265334 | 0.69 | — | — | |
| Cyclopentane SCHEMBL10524012 | 0.69 | — | — | |
| Cyclopentane SCHEMBL30979206 | 0.69 | ADH1B (0.30) | — | |
| Cyclooctane SCHEMBL7940492 | 0.69 | ADH1B (0.30) | — | |
| Cyclohexane SCHEMBL6265151 | 0.69 | ADH1B (0.30) | — | |
| Cycloheptane SCHEMBL11874125 | 0.69 | ADH1B (0.30) | — | |
| SCHEMBL290742 | 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-104419326-A | Slurry composition for chemical mechanical polishing | COWON INNOTECH INC | 2015-03-18 | — | — | CN | claimed |