⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25191386 | 1.00 | — | — | |
| SCHEMBL1532707 | 0.80 | — | — | |
| SCHEMBL2008022 | 0.80 | — | — | |
| SCHEMBL10651387 | 0.70 | — | — | |
| SCHEMBL19747687 | 0.70 | MAPK1 (0.31) | — | |
| SCHEMBL8003854 | 0.66 | MAPK1 (0.35) | — | |
| SCHEMBL8003858 | 0.66 | MAPK1 (0.35) | — | |
| SCHEMBL20362761 | 0.64 | — | — | |
| SCHEMBL8016106 | 0.64 | G6PD (0.32) | — | |
| SCHEMBL8016108 | 0.64 | G6PD (0.32) | — |
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-57130983-A | — | — | None | — | — | JP | disclosed |
| JP-S57130983-A | NOVEL TETRAHYDROFURAN DERIVATIVE AND PERFUMERY COMPOSITION CONTAINING THE SAME | TAKASAGO CORP | 1982-08-13 | — | — | JP | disclosed |