⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2070772 | 0.87 | — | — | |
| SCHEMBL13659733 | 0.65 | — | — | |
| SCHEMBL1543389 | 0.65 | CYP1A2 (0.32) | — | |
| SCHEMBL15337522 | 0.62 | — | — | |
| SCHEMBL321303 | 0.62 | LMNA (0.32) | — | |
| Ethylene SCHEMBL28641046 | 0.62 | CYP1A2 (0.31) | — | |
| SCHEMBL10339691 | 0.61 | — | — | |
| SCHEMBL11549002 | 0.60 | CA2 (0.37) | — | |
| SCHEMBL28952671 | 0.59 | — | — | |
| SCHEMBL13655648 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0212200-B1 | PYRIDINE DERIVATIVES AND HERBICIDAL COMPOSITION | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1993-03-24 | — | — | EP | disclosed |
| US-4824474-A | Quinoline derivatives and herbicidal compositions and method of use thereof | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1989-04-25 | — | — | US | disclosed |
| US-4696694-A | Pyridine derivatives and their herbicidal compositions | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1987-09-29 | — | — | US | disclosed |
| EP-0212200-A2 | Pyridine derivatives and herbicidal composition | NISSAN CHEMICAL INDUSTRIES LTD. (JP) | 1987-03-04 | — | — | EP | disclosed |