⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5187 | 0.95 | — | — | |
| SCHEMBL1144463 | 0.95 | — | — | |
| SCHEMBL9766049 | 0.90 | — | — | |
| Ammonia Solution, Strong SCHEMBL4642805 | 0.90 | — | — | |
| SCHEMBL5279 | 0.90 | — | — | |
| SCHEMBL936708 | 0.86 | — | — | |
| SCHEMBL12802725 | 0.86 | — | — | |
| Cyclopentane SCHEMBL9453154 | 0.86 | — | — | |
| SCHEMBL6243959 | 0.86 | — | — | |
| SCHEMBL11372758 | 0.86 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106283621-B | Polyurethane fiber dry spinning no silicon oil agent composition and preparation method thereof | 烟台锐泽化学品有限公司 | 2018-10-02 | — | — | CN | disclosed |
| CN-106283621-A | Polyurethane fiber dry spinning is with without silicon oil agent composition and preparation method thereof | 烟台中纺锐泽化学制品有限公司 | 2017-01-04 | — | — | CN | disclosed |