⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27758336 | 0.79 | HPGD (0.35) | — | |
| SCHEMBL9665535 | 0.77 | MAPT (0.30) | — | |
| SCHEMBL799192 | 0.77 | — | — | |
| SCHEMBL27415406 | 0.76 | — | — | |
| SCHEMBL3650415 | 0.74 | — | — | |
| SCHEMBL21592509 | 0.72 | — | — | |
| SCHEMBL28163260 | 0.72 | ALDH1A1 (0.36) | — | |
| SCHEMBL14558217 | 0.72 | MAPT (0.35) | — | |
| SCHEMBL20034867 | 0.72 | MAPT (0.35) | — | |
| SCHEMBL3667514 | 0.71 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8754010-B2 | Herbicidal mixtures | BASF AKTIENGESELLSCHAFT (DE) | 2014-06-17 | — | — | US | disclosed |
| US-20120302441-A1 | HERBICIDAL MIXTURES | BASF AKTIENGESELLSCHAFT (DE) | 2012-11-29 | — | — | US | disclosed |
| EP-2215909-A2 | HERBICIDAL MIXTURES | BASF SE (DE) | 2010-08-11 | — | — | EP | disclosed |
| US-20060276341-A1 | Herbicidal mixtures | BASF AKTIENGESELLSCHAFT (DE) | 2006-12-07 | — | — | US | disclosed |
| CN-1787742-A | Herbicidal mixtures | BASF AG (DE) | 2006-06-14 | — | — | CN | disclosed |
| EP-1608222-A2 | HERBICIDAL MIXTURES | BASF AKTIENGESELLSCHAFT (DE) | 2005-12-28 | — | — | EP | disclosed |
| WO-2004080182-A2 | HERBICIDAL MIXTURES | BASF AKTIENGESELLSCHAFT (DE) | 2004-09-23 | — | — | WO | disclosed |