⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6657856 | 0.76 | — | — | |
| SCHEMBL9953874 | 0.72 | — | — | |
| SCHEMBL15973215 | 0.72 | — | — | |
| SCHEMBL7841638 | 0.72 | — | — | |
| SCHEMBL7411015 | 0.70 | — | — | |
| SCHEMBL9278597 | 0.69 | — | — | |
| SCHEMBL11046851 | 0.68 | — | — | |
| SCHEMBL10588594 | 0.68 | — | — | |
| SCHEMBL9662646 | 0.68 | — | — | |
| SCHEMBL8695942 | 0.65 | CA1 (0.32) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105208856-B | Herbicidal combinations for the safe comprising the formic acid derivates of pyridine 2 of corn (corn) | 美国陶氏益农公司 | 2017-12-01 | — | — | CN | disclosed |
| WO-2017027442-A1 | SAFENED HERBICIDAL COMPOSITIONS COMPRISING PYRIDINE CARBOXYLIC ACIDS | DOW AGROSCIENCES LLC (US) | 2017-02-16 | — | — | WO | disclosed |
| EP-0388186-A1 | External regulation of gene expression | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-09-19 | — | — | EP | disclosed |