⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5413895 | 0.58 | — | — | |
| SCHEMBL1890049 | 0.54 | — | — | |
| SCHEMBL31357464 | 0.52 | IDO1 (0.52) | — | |
| SCHEMBL31511817 | 0.47 | S100A4 (0.54) | — | |
| SCHEMBL7719621 | 0.47 | S100A4 (0.54) | — | |
| SCHEMBL13010024 | 0.47 | ALDH1A1 (0.33) | — | |
| SCHEMBL8576550 | 0.47 | CDC25B (0.31) | — | |
| SCHEMBL31185550 | 0.46 | S100A4 (0.36) | — | |
| SCHEMBL4443898 | 0.46 | CDC25B (0.39) | — | |
| SCHEMBL10945354 | 0.45 | MEN1 (0.38) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6531496-B1 | Pesticides in crop protection | BAYER AKTIENGESELLSCHAFT (DE) | 2003-03-11 | — | — | US | claimed |
| JP-2002543068-A | — | — | 2002-12-17 | — | — | JP | claimed |
| EP-1173428-A1 | O-ARYL DITHIAZOLE DIOXIDES | Bayer Aktiengesellschaft (DE) | 2002-01-23 | — | — | EP | claimed |
| WO-2000064881-A1 | O-ARYL DITHIAZOLE DIOXIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-11-02 | — | — | WO | claimed |
| US-6531496-B1 | Pesticides in crop protection | BAYER AKTIENGESELLSCHAFT (DE) | 2003-03-11 | — | — | US | disclosed |
| EP-1173428-A1 | O-ARYL DITHIAZOLE DIOXIDES | Bayer Aktiengesellschaft (DE) | 2002-01-23 | — | — | EP | disclosed |
| WO-2000064881-A1 | O-ARYL DITHIAZOLE DIOXIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-11-02 | — | — | WO | disclosed |