⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL615160 | 0.83 | — | — | |
| SCHEMBL20335176 | 0.73 | — | — | |
| SCHEMBL3158674 | 0.73 | — | — | |
| SCHEMBL82400 | 0.73 | — | — | |
| SCHEMBL4751402 | 0.71 | — | — | |
| SCHEMBL2586899 | 0.71 | — | — | |
| SCHEMBL3160339 | 0.70 | — | — | |
| SCHEMBL9704174 | 0.70 | TSHR (0.53) | — | |
| SCHEMBL396937 | 0.69 | — | — | |
| SCHEMBL5416953 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-3193791-A | — | — | None | — | — | JP | disclosed |
| JP-H03193791-A | DI(METH)ACRYLOXYALKYL DERIVATIVE | TOSHIBA SILICONE CO LTD | 1991-08-23 | — | — | JP | disclosed |