⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2300316 | 0.95 | PPM1B (0.31) | — | |
| SCHEMBL128990 | 0.80 | PPM1B (0.31) | — | |
| SCHEMBL22534428 | 0.76 | — | — | |
| SCHEMBL23441660 | 0.75 | — | — | |
| SCHEMBL4200508 | 0.75 | — | — | |
| SCHEMBL23175140 | 0.75 | — | — | |
| SCHEMBL797868 | 0.74 | — | — | |
| SCHEMBL18240041 | 0.73 | PPM1B (0.33) | — | |
| SCHEMBL2780876 | 0.73 | — | — | |
| SCHEMBL3747862 | 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-108473790-A | Water-based zinc-rich pre-structured primer | 晓温-威廉姆斯公司 | 2018-08-31 | — | — | CN | disclosed |