⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8433881 | 0.82 | POLB (0.51) | — | |
| SCHEMBL8314802 | 0.82 | SMN1; SMN2 (0.49) | — | |
| SCHEMBL8435761 | 0.81 | MLYCD (0.40) | — | |
| SCHEMBL875553 | 0.80 | — | — | |
| SCHEMBL7604693 | 0.80 | — | — | |
| SCHEMBL8436643 | 0.79 | TAS1R3 (0.46) | — | |
| SCHEMBL5141953 | 0.78 | — | — | |
| SCHEMBL8438019 | 0.78 | CA12 (0.46) | — | |
| SCHEMBL5141952 | 0.78 | — | — | |
| SCHEMBL26680098 | 0.77 | MMP1 (0.45) | — |
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-0777658-B1 | SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS | BASF AG (DE) | 1999-12-15 | — | — | EP | disclosed |
| US-5885934-A | HERBICIDES OR FOR THE DESICCATION/DEFOLIATION OF PLANTS | BASF AKTIENGESELLSCHAFT (DE) | 1999-03-23 | — | — | US | disclosed |
| CN-1158122-A | Substituted triazolinones as plant protective agents | BASF AG (DE) | 1997-08-27 | — | — | CN | disclosed |
| EP-0777658-A1 | SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 1997-06-11 | — | — | EP | disclosed |
| WO-1996005179-A1 | SUBSTITUTED TRIAZOLINONES AS PLANT PROTECTIVE AGENTS | BASF AKTIENGESELLSCHAFT (DE) | 1996-02-22 | — | — | WO | disclosed |