⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL820002 | 0.67 | TSHR (0.33) | — | |
| SCHEMBL9487362 | 0.67 | FOLH1 (0.46) | — | |
| SCHEMBL4096637 | 0.67 | TSHR (0.38) | — | |
| SCHEMBL4107685 | 0.65 | — | — | |
| SCHEMBL12736693 | 0.65 | CA1 (0.42) | — | |
| SCHEMBL27850966 | 0.65 | PMP22 (0.44) | — | |
| SCHEMBL2429511 | 0.65 | ALDH1A1 (0.43) | — | |
| SCHEMBL28138919 | 0.64 | — | — | |
| SCHEMBL819370 | 0.62 | TSHR (0.30) | — | |
| SCHEMBL21874813 | 0.62 | TSHR (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090136551-A1 | Substituted Dicyanoalkanes For Combating Animal Pests | BASF AKTIENGESELLSCHAFT (DE) | 2009-05-28 | — | — | US | disclosed |
| EP-1385817-B1 | MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL CO (JP) | 2008-12-03 | — | — | EP | disclosed |
| US-20080227635-A1 | Dicyano Alkanoic Acid Amides for Combating Animal Pests | BASF AKTIENGESELLSCHAFT (DE) | 2008-09-18 | — | — | US | disclosed |
| US-7402691-B2 | Malononitrile compounds and their use as pesticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2008-07-22 | — | — | US | disclosed |
| US-7402691-B2 | Malononitrile compounds and their use as pesticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2008-07-22 | — | — | US | disclosed |
| EP-1916895-A1 | DICYANO ALKANOIC ACID AMIDES FOR COMBATING ANIMAL PESTS | BASF SE (DE) | 2008-05-07 | — | — | EP | disclosed |
| EP-1912958-A1 | SUBSTITUTED MALONONITRILE COMPOUNDS FOR COMBATING ANIMAL PESTS | BASF SE (DE) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007017414-A1 | SUBSTITUTED MALONONITRILE COMPOUNDS FOR COMBATING ANIMAL PESTS | BASF SE (DE) | 2007-02-15 | — | — | WO | disclosed |
| WO-2007014899-A1 | DICYANO ALKANOIC ACID AMIDES FOR COMBATING ANIMAL PESTS | BASF SE (DE) | 2007-02-08 | — | — | WO | disclosed |
| WO-2006122949-A1 | MALONONITRILES AND THEIR USE AS PESTICIDES | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-23 | — | — | WO | disclosed |
| EP-1521528-B1 | MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL CO (JP) | 2006-11-22 | — | — | EP | disclosed |
| US-7026340-B2 | Malononitrile compounds and their use as pesticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-04-11 | — | — | US | disclosed |
| US-7011838-B2 | Malononitrile compounds and their use as pesticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-03-14 | — | — | US | disclosed |
| US-20050209323-A1 | Malononitrile compounds and their use as pesticides | OTAKA KEN | 2005-09-22 | — | — | US | disclosed |
| US-20050176784-A1 | Malononitrile compounds and their use as pesticides | SUMITOMO CHECMICAL COMPANY, LIMITED (JP) | 2005-08-11 | — | — | US | disclosed |
| EP-1521528-A1 | MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES | Sumitomo Chemical Company, Limited (JP) | 2005-04-13 | — | — | EP | disclosed |
| US-20040138065-A1 | Malononitrile compounds and their use as pesticides | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-07-15 | — | — | US | disclosed |
| EP-1385817-A2 | MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 2004-02-04 | — | — | EP | disclosed |
| WO-2004006677-A1 | MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2004-01-22 | — | — | WO | disclosed |
| WO-2002090320-A2 | MALONONITRILE COMPOUNDS AND THEIR USE AS PESTICIDES | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-11-14 | — | — | WO | disclosed |