⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18502219 | 0.82 | — | — | |
| SCHEMBL18502233 | 0.77 | CHRM2 (0.32) | — | |
| SCHEMBL18502234 | 0.76 | — | — | |
| SCHEMBL18502224 | 0.76 | PIK3CD (0.31) | — | |
| SCHEMBL18502228 | 0.75 | SLC22A1 (0.30) | — | |
| SCHEMBL18502210 | 0.74 | — | — | |
| SCHEMBL18502220 | 0.73 | — | — | |
| SCHEMBL20243268 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL21026948 | 0.69 | — | — | |
| SCHEMBL20663578 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20170044188-A1 | COPPER COMPOUND, STARTING MATERIAL FOR FORMING THIN FILM, AND METHOD FOR MANUFACTURING THIN FILM | ADEKA CORPORATION (JP) | 2017-02-16 | — | — | US | disclosed |