⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3841963 | 0.82 | — | — | |
| SCHEMBL2901849 | 0.82 | — | — | |
| SCHEMBL2906873 | 0.72 | KMT2A (0.36) | — | |
| SCHEMBL9514196 | 0.68 | ALDH1A1 (0.33) | — | |
| SCHEMBL8964833 | 0.65 | POLB (0.33) | — | |
| SCHEMBL8965355 | 0.63 | PRNP (0.32) | — | |
| SCHEMBL28504619 | 0.62 | LMNA (0.34) | — | |
| Isopropylamine SCHEMBL9466355 | 0.62 | ALDH1A1 (0.35) | — | |
| SCHEMBL1720501 | 0.61 | — | — | |
| SCHEMBL1170450 | 0.61 | ALDH1A1 (0.38) | — |
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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1260140-B1 | Isothiazolecarbamide derivatives for crop protection | BAYER CROPSCIENCE AG (DE) | 2010-08-18 | — | — | EP | claimed |
| EP-2145540-A1 | Isothiazol carboxylic acid amides and their use in the protection of plants | Bayer CropScience AG (DE) | 2010-01-20 | — | — | EP | claimed |
| EP-2145539-A1 | Isothiazolecarbamide derivatives for crop protection | Bayer CropScience AG (DE) | 2010-01-20 | — | — | EP | claimed |
| EP-2132988-A1 | Isothiazole carboxylic acid amides and their use in the protection of plants | Bayer CropScience AG (DE) | 2009-12-16 | — | — | EP | claimed |
| EP-1114038-B1 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES | BAYER CROPSCIENCE AG (DE) | 2003-12-03 | — | — | EP | claimed |
| EP-1260140-A1 | Isothiazolecarbamide derivatives for crop protection | Bayer CropScience AG (DE) | 2002-11-27 | — | — | EP | claimed |
| EP-1114038-A1 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES | Bayer Aktiengesellschaft (DE) | 2001-07-11 | — | — | EP | claimed |
| EP-1049683-A2 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES AND THE APPLICATION THEREOF IN ORDER TO PROTECT PLANTS | BAYER AG (DE) | 2000-11-08 | — | — | EP | claimed |
| WO-2000015622-A1 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-03-23 | — | — | WO | claimed |
| WO-1999024413-A2 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES AND THE APPLICATION THEREOF IN ORDER TO PROTECT PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 1999-05-20 | — | — | WO | claimed |
| EP-1260140-B1 | Isothiazolecarbamide derivatives for crop protection | BAYER CROPSCIENCE AG (DE) | 2010-08-18 | — | — | EP | disclosed |
| EP-2145540-A1 | Isothiazol carboxylic acid amides and their use in the protection of plants | Bayer CropScience AG (DE) | 2010-01-20 | — | — | EP | disclosed |
| EP-2145539-A1 | Isothiazolecarbamide derivatives for crop protection | Bayer CropScience AG (DE) | 2010-01-20 | — | — | EP | disclosed |
| EP-2132988-A1 | Isothiazole carboxylic acid amides and their use in the protection of plants | Bayer CropScience AG (DE) | 2009-12-16 | — | — | EP | disclosed |
| EP-1114038-B1 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES | BAYER CROPSCIENCE AG (DE) | 2003-12-03 | — | — | EP | disclosed |
| EP-1260140-A1 | Isothiazolecarbamide derivatives for crop protection | Bayer CropScience AG (DE) | 2002-11-27 | — | — | EP | disclosed |
| EP-1114038-A1 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES | Bayer Aktiengesellschaft (DE) | 2001-07-11 | — | — | EP | disclosed |
| EP-1049683-A2 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES AND THE APPLICATION THEREOF IN ORDER TO PROTECT PLANTS | BAYER AG (DE) | 2000-11-08 | — | — | EP | disclosed |
| WO-2000015622-A1 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2000-03-23 | — | — | WO | disclosed |
| WO-1999024413-A2 | ISOTHIAZOLE CARBOXYLIC ACID AMIDES AND THE APPLICATION THEREOF IN ORDER TO PROTECT PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 1999-05-20 | — | — | WO | disclosed |