⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7471125 | 0.82 | POLB (0.34) | — | |
| SCHEMBL7475191 | 0.72 | — | — | |
| SCHEMBL7470198 | 0.72 | — | — | |
| SCHEMBL7475102 | 0.69 | CETP (0.33) | — | |
| SCHEMBL7468265 | 0.68 | MAPT (0.41) | — | |
| SCHEMBL7468644 | 0.68 | AHR (0.36) | — | |
| SCHEMBL7466073 | 0.65 | ALDH1A1 (0.38) | — | |
| SCHEMBL1483770 | 0.64 | TSHR (0.41) | — | |
| SCHEMBL7466018 | 0.64 | CYP1A2 (0.39) | — | |
| SCHEMBL7474543 | 0.63 | HSD17B10 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0596359-B1 | Fluorinated 1,3-benzo- and 1,3-pyrido-dioxoles, process for their preparation and their use for the preparation of plant-protective agents | BAYER AG (DE) | 2002-07-03 | — | — | EP | disclosed |
| US-5482956-A | ANTIPROTOZOA AGENTS FOR ANIMALS OR INSECTS | BAYER AKTIENGESELLSCHAFT (DE) | 1996-01-09 | — | — | US | disclosed |
| US-5420309-A | Plant saftening agents, insecticides or nematocides | BAYER AKTIENGESELLSCHAFT (DE) | 1995-05-30 | — | — | US | disclosed |
| EP-0597304-A1 | Use of substituted benzimidazoles | BAYER AG (DE) | 1994-05-18 | — | — | EP | disclosed |
| EP-0596359-A2 | Fluorinated 1,3-benzo- and 1,3-pyrido-dioxoles, process for their preparation and their use for the preparation of plant-protective agents | BAYER AG (DE) | 1994-05-11 | — | — | EP | disclosed |