⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL533401 | 0.64 | — | — | |
| SCHEMBL56855 | 0.64 | — | — | |
| SCHEMBL38651245 | 0.59 | — | — | |
| SCHEMBL448205 | 0.58 | — | — | |
| SCHEMBL5749529 | 0.58 | — | — | |
| SCHEMBL15547342 | 0.58 | — | — | |
| SCHEMBL450323 | 0.58 | — | — | |
| SCHEMBL2426382 | 0.58 | — | — | |
| SCHEMBL2199096 | 0.58 | — | — | |
| SCHEMBL6292701 | 0.58 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5298480-A | Plant growth regulators | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1994-03-29 | — | — | US | disclosed |
| WO-1993010103-A1 | HERBICIDAL SULFONYLURIA DERIVATIVES | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1993-05-27 | — | — | WO | disclosed |
| EP-0525768-A1 | Tetralones with pharmacological activity | J. URIACH & CIA. S.A. (ES) | 1993-02-03 | — | — | EP | disclosed |
| US-5132307-A | TETRALIN COMPOUNDS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1992-07-21 | — | — | US | disclosed |
| WO-1992006965-A1 | HERBICIDAL SULFONYLUREA DERIVATIVES | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1992-04-30 | — | — | WO | disclosed |
| EP-0457581-A1 | Herbicidal sulfonylurea derivatives | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1991-11-21 | — | — | EP | disclosed |
| EP-0368160-A1 | Tetralin derivatives | MERCK PATENT GmbH (DE) | 1990-05-16 | — | — | EP | disclosed |
| EP-0363883-A1 | Chroman derivatives | MERCK PATENT GmbH (DE) | 1990-04-18 | — | — | EP | disclosed |