⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28661586 | 0.78 | NPC1 (0.37) | — | |
| SCHEMBL23748938 | 0.77 | LMNA (0.44) | — | |
| SCHEMBL4233726 | 0.76 | THRB (0.34) | — | |
| SCHEMBL27660661 | 0.74 | ALOX15 (0.39) | — | |
| SCHEMBL27482017 | 0.74 | NPC1 (0.32) | — | |
| SCHEMBL30515023 | 0.71 | ALDH1A1 (0.50) | — | |
| SCHEMBL12936018 | 0.69 | — | — | |
| SCHEMBL30531423 | 0.69 | CA2 (0.37) | — | |
| SCHEMBL27487201 | 0.69 | HTT (0.33) | — | |
| SCHEMBL27984234 | 0.68 | PARP15 (0.42) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0565593-B1 | REDUCING PESTICIDAL INTERACTIONS IN CROPS | MONSANTO CO (US) | 1999-03-03 | — | — | EP | claimed |
| EP-0603240-B1 | SAFENING HERBICIDAL PYRAZOLYLSULFONYLUREAS | MONSANTO CO (US) | 1998-12-02 | — | — | EP | claimed |
| CN-1035753-A | Make cultivated plant avoid the thiazole-5-Carboxylamide of highy potent herbicide to the plant poisoning effect | CIBA GEIGY AG (CH) | 1989-09-27 | — | — | CN | claimed |
| EP-2401256-B1 | Compounds as bradykinin B1 antagonists | BOEHRINGER INGELHEIM INT (DE) | 2013-04-17 | — | — | EP | disclosed |
| EP-2401256-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | Boehringer Ingelheim International GmbH (DE) | 2012-01-04 | — | — | EP | disclosed |
| WO-2010097372-A1 | COMPOUNDS AS BRADYKININ B1 ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-09-02 | — | — | WO | disclosed |
| EP-0775124-A1 | HERBICIDAL SACCHARIN CARBOXYLIC ACID DERIVATIVES AND METHOD FOR THEIR PREPARATION | BASF AKTIENGESELLSCHAFT (DE) | 1997-05-28 | — | — | EP | disclosed |
| WO-1996005184-A1 | HERBICIDAL SACCHARIN CARBOXYLIC ACID DERIVATIVES AND METHOD FOR THEIR PREPARATION | BASF AKTIENGESELLSCHAFT (DE) | 1996-02-22 | — | — | WO | disclosed |
| US-4992434-A | Prevention of infestation of plants by phytopathogenic microorganisms | CIBA-GEIGY CORPORATION (US) | 1991-02-12 | — | — | US | disclosed |
| CN-1035753-A | Make cultivated plant avoid the thiazole-5-Carboxylamide of highy potent herbicide to the plant poisoning effect | CIBA GEIGY AG (CH) | 1989-09-27 | — | — | CN | disclosed |