⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5254768 | 0.77 | — | — | |
| SCHEMBL5071840 | 0.72 | — | — | |
| SCHEMBL27609769 | 0.72 | — | — | |
| SCHEMBL11759289 | 0.71 | — | — | |
| SCHEMBL18518038 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL9719333 | 0.69 | — | — | |
| SCHEMBL8733219 | 0.66 | — | — | |
| SCHEMBL19583436 | 0.65 | — | — | |
| Nitric Acid SCHEMBL10708763 | 0.64 | CA5A (0.35) | — | |
| SCHEMBL7551868 | 0.62 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10131649-B2 | Bicyclic compounds as pest control agents | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2018-11-20 | — | — | US | disclosed |
| US-20170327487-A1 | BICYCLIC COMPOUNDS AS PEST CONTROL AGENTS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2017-11-16 | — | — | US | disclosed |
| EP-1100788-B1 | SUBSTITUTED QUINAZOLINE DERIVATIVES | WYETH CORP (US) | 2005-11-09 | — | — | EP | disclosed |
| US-6384223-B1 | ACYLATION OF THE 3-CYANO-4-(DIMETHYLFORMAMIDYL) ANILINE; CYCLIZATION; AMINATION; DEHYDROGENATION | AMERICAN HOME PRODUCTS CORPORATION | 2002-05-07 | — | — | US | disclosed |
| EP-1100788-A1 | SUBSTITUTED QUINAZOLINE DERIVATIVES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000006555-A1 | SUBSTITUTED QUINAZOLINE DERIVATIVES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-02-10 | — | — | WO | disclosed |
| US-5314880-A | Platelet activating factor antagonist | BRITISH BIO-TECHNOLOGY LIMITED (GB) | 1994-05-24 | — | — | US | disclosed |
| EP-0468971-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES | BRITISH BIO-TECHNOLOGY LIMITED (GB) | 1992-02-05 | — | — | EP | disclosed |
| WO-1990009997-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES | BRITISH BIO-TECHNOLOGY LIMITED (GB) | 1990-09-07 | — | — | WO | disclosed |