⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10880401 | 0.73 | — | — | |
| SCHEMBL7608862 | 0.72 | EHMT2 (0.40) | — | |
| SCHEMBL21307460 | 0.71 | — | — | |
| SCHEMBL1848524 | 0.69 | — | — | |
| Ditiocarb SCHEMBL21221398 | 0.69 | ABCB11 (0.88) | — | |
| SCHEMBL10419005 | 0.67 | — | — | |
| SCHEMBL2270733 | 0.67 | — | — | |
| SCHEMBL11301444 | 0.67 | — | — | |
| SCHEMBL689389 | 0.67 | — | — | |
| Ditiocarb SCHEMBL48382 | 0.67 | — | — |
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-5319045-A | Copolymer and composition containing the copolymer | MITSUBISHI KASEI CORPORATION (JP) | 1994-06-07 | — | — | US | disclosed |