Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| SCHEMBL7550001 | 1.00 | CA12 (0.38) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL1751285 | 0.88 | CA12 (0.40) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL1751283 | 0.88 | CA12 (0.40) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL10518873 | 0.84 | CA12 (0.38) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL5803124 | 0.83 | CA12 (0.42) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL5803125 | 0.83 | CA12 (0.42) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL5802975 | 0.80 | HTT (0.36) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL5802974 | 0.80 | HTT (0.36) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL4973073 | 0.79 | CA12 (0.35) | CA12CA1CA2ESR1CA9 | |
| SCHEMBL4973069 | 0.79 | CA12 (0.35) | CA12CA1CA2ESR1CA9 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0872476-B1 | Herbicidal substance based on 2,6-dichloro-3-fluoro-benzonitrile and new intermediate compounds | BAYER AG (DE) | 2002-07-03 | — | — | EP | claimed |
| EP-0872476-A2 | Herbicidal substance based on 2,6-dichloro-3-fluoro-benzonitrile and new intermediate compounds | BAYER AG (DE) | 1998-10-21 | — | — | EP | claimed |
| US-5824817-A | Herbicidal compositions based on 2,6-dichloro-3-fluoro-benzonitrile, and new intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1998-10-20 | — | — | US | claimed |
| EP-0713862-A2 | Herbicidal substance based on 2,6-dichloro-3-fluoro-benzonitrile and new intermediate compounds | BAYER AG (DE) | 1996-05-29 | — | — | EP | claimed |
| JP-8259510-A | — | — | None | — | — | JP | disclosed |
| EP-0872476-B1 | Herbicidal substance based on 2,6-dichloro-3-fluoro-benzonitrile and new intermediate compounds | BAYER AG (DE) | 2002-07-03 | — | — | EP | disclosed |
| EP-0941988-A2 | Benzamidoxime derivatives, intermediates and process for their preparation and their use as fungicides | BASF AKTIENGESELLSCHAFT (DE) | 1999-09-15 | — | — | EP | disclosed |
| EP-0872476-A2 | Herbicidal substance based on 2,6-dichloro-3-fluoro-benzonitrile and new intermediate compounds | BAYER AG (DE) | 1998-10-21 | — | — | EP | disclosed |
| US-5824817-A | Herbicidal compositions based on 2,6-dichloro-3-fluoro-benzonitrile, and new intermediates | BAYER AKTIENGESELLSCHAFT (DE) | 1998-10-20 | — | — | US | disclosed |
| EP-0713862-B1 | Herbicidal substance based on 2,6-dichloro-3-fluoro- benzonitrile. | BAYER AG (DE) | 1998-09-16 | — | — | EP | disclosed |
| JP-H08259510-A | HERBICIDAL COMPOSITION BASED ON 2,6-DICHLORO-3-FLUORO-BENZONITRILE, AND NEW INTERMEDIATE | BAYER AG | 1996-10-08 | — | — | JP | disclosed |
| EP-0713862-A2 | Herbicidal substance based on 2,6-dichloro-3-fluoro-benzonitrile and new intermediate compounds | BAYER AG (DE) | 1996-05-29 | — | — | EP | disclosed |