⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9674714 | 0.72 | — | — | |
| SCHEMBL20152120 | 0.70 | RAB9A (0.58) | — | |
| SCHEMBL687799 | 0.69 | — | — | |
| SCHEMBL13750190 | 0.69 | MAPK1 (0.44) | — | |
| SCHEMBL7817837 | 0.69 | — | — | |
| SCHEMBL3804136 | 0.68 | — | — | |
| SCHEMBL12218851 | 0.68 | MAPT (0.45) | — | |
| SCHEMBL159035 | 0.68 | — | — | |
| SCHEMBL11375936 | 0.67 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL9850915 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5510320-A | EXCELLENT CONTROL OF BLACKGRASS AND WILD OATS AND OTHER WEEDS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-04-23 | — | — | US | disclosed |
| EP-0610314-A1 | HERBICIDAL TRIAZOLECARBOXAMIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-08-17 | — | — | EP | disclosed |
| WO-1993009100-A1 | HERBICIDAL TRIAZOLECARBOXAMIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-05-13 | — | — | WO | disclosed |