⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18868690 | 0.82 | — | — | |
| SCHEMBL25538872 | 0.80 | DNM1 (0.34) | — | |
| SCHEMBL10678873 | 0.77 | HTR2A (0.34) | — | |
| SCHEMBL5948490 | 0.76 | — | — | |
| SCHEMBL19397678 | 0.76 | — | — | |
| SCHEMBL20682419 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL24693244 | 0.73 | SIGMAR1 (0.32) | — | |
| SCHEMBL12059254 | 0.73 | SIGMAR1 (0.31) | — | |
| SCHEMBL6543821 | 0.73 | — | — | |
| SCHEMBL129815 | 0.72 | — | — |
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-109689970-A | Low molecular weight dried powder as papermaking dry strength agents | 艺康美国股份有限公司 | 2019-04-26 | — | — | CN | disclosed |