⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16638400 | 0.74 | — | — | |
| SCHEMBL2178928 | 0.70 | — | — | |
| SCHEMBL3479722 | 0.67 | — | — | |
| SCHEMBL14438932 | 0.67 | — | — | |
| SCHEMBL15841066 | 0.67 | — | — | |
| SCHEMBL8428628 | 0.56 | — | — | |
| SCHEMBL388893 | 0.56 | — | — | |
| SCHEMBL58775 | 0.56 | — | — | |
| Phosphine SCHEMBL24869468 | 0.53 | — | — | |
| SCHEMBL15213159 | 0.53 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2575447-A1 | LIQUID COMPOSITIONS COMPRISING A SUSTAINED RELEASE SYSTEM FOR INSECTICIDES | Exosect Limited (GB) | 2013-04-10 | — | — | EP | claimed |
| EP-1480944-A2 | SUBSTITUTED ARYL KETONES | Bayer CropScience Aktiengesellschaft (DE) | 2004-12-01 | — | — | EP | claimed |
| WO-2003074475-A2 | SUBSTITUTED ARYL KETONES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2003-09-12 | — | — | WO | claimed |
| US-5610121-A | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-03-11 | — | — | US | claimed |
| EP-1480944-A2 | SUBSTITUTED ARYL KETONES | Bayer CropScience Aktiengesellschaft (DE) | 2004-12-01 | — | — | EP | disclosed |
| WO-2003074475-A2 | SUBSTITUTED ARYL KETONES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2003-09-12 | — | — | WO | disclosed |
| US-5610121-A | HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-03-11 | — | — | US | disclosed |
| EP-0642506-A1 | HETEROCYCLICALLY BISUBSTITUTED SULPHONYL AMINO(THIO)CARBONYL COMPOUNDS | BAYER AG (DE) | 1995-03-15 | — | — | EP | disclosed |
| WO-1993024482-A1 | HETEROCYCLICALLY BISUBSTITUTED SULPHONYL AMINO(THIO)CARBONYL COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1993-12-09 | — | — | WO | disclosed |
| US-4309438-A | BACTERICIDES | MERCK & CO., INC. (US) | 1982-01-05 | — | — | US | disclosed |
| US-4235917-A | N-Alkyl-N-acyl derivatives of thienamycin | MERCK & CO., INC. (US) | 1980-11-25 | — | — | US | disclosed |
| US-4119780-A | 2(Isopropyldithio)benzimidazole | MONSANTO COMPANY (US) | 1978-10-10 | — | — | US | disclosed |
| US-4006155-A | Method for preparation of phosphorus polysulfides | MONSANTO COMPANY (US) | 1977-02-01 | — | — | US | disclosed |