⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10709672 | 0.85 | — | — | |
| SCHEMBL11127760 | 0.75 | — | — | |
| SCHEMBL3817928 | 0.73 | — | — | |
| Ammonia Solution, Strong SCHEMBL28712643 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL28710906 | 0.71 | — | — | |
| SCHEMBL15263698 | 0.69 | ALPG (0.53) | — | |
| SCHEMBL7437857 | 0.69 | — | — | |
| Methane SCHEMBL11821836 | 0.67 | ALPG (0.50) | — | |
| Ethane SCHEMBL9632438 | 0.67 | ALPG (0.50) | — | |
| SCHEMBL27272641 | 0.67 | ALPG (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1889029-A1 | METHOD FOR DETERMINING RESIDUES IN PLASTICS | BASF AKTIENGESELLSCHAFT (DE) | 2008-02-20 | — | — | EP | claimed |
| WO-2006125647-A1 | METHOD FOR DETERMINING RESIDUES IN PLASTICS | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-30 | — | — | WO | claimed |
| US-20080202259-A1 | Method For Determining Pesticide Residues in Soil or Plant Material | BASF AKTIENGESELLSCHAFT (DE) | 2008-08-28 | — | — | US | disclosed |
| US-20080192251-A1 | Method For Determining Residues in Plastics | BASF AKTIENGESELLSCHAFT (DE) | 2008-08-14 | — | — | US | disclosed |
| EP-1889029-A1 | METHOD FOR DETERMINING RESIDUES IN PLASTICS | BASF AKTIENGESELLSCHAFT (DE) | 2008-02-20 | — | — | EP | disclosed |
| EP-1889028-A1 | METHOD FOR DETERMINING PESTICIDE RESIDUES IN SOIL OR PLANT MATERIAL | BASF AKTIENGESELLSCHAFT (DE) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006125647-A1 | METHOD FOR DETERMINING RESIDUES IN PLASTICS | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-30 | — | — | WO | disclosed |
| WO-2006125644-A1 | METHOD FOR DETERMINING PESTICIDE RESIDUES IN SOIL OR PLANT MATERIAL | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-30 | — | — | WO | disclosed |