⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8097987 | 0.91 | — | — | |
| SCHEMBL73458 | 0.80 | — | — | |
| SCHEMBL180147 | 0.73 | — | — | |
| SCHEMBL5932903 | 0.73 | — | — | |
| SCHEMBL5936430 | 0.69 | OPRM1 (0.31) | — | |
| SCHEMBL11073291 | 0.65 | TSHR (0.46) | — | |
| SCHEMBL73033 | 0.65 | — | — | |
| SCHEMBL2531 | 0.65 | — | — | |
| SCHEMBL5889556 | 0.65 | TSHR (0.46) | — | |
| SCHEMBL2068301 | 0.65 | — | — |
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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0425571-B2 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS | MALLINCKRODT MEDICAL INC (US) | 2000-09-20 | — | — | EP | claimed |
| EP-0425571-B1 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS | MALLINCKRODT INC (US) | 1996-09-11 | — | — | EP | claimed |
| US-5137711-A | PARAMAGNETIC DTPA AND EDTA ALKOXYALKYLAMIDE COMPLEXES AS MRI AGENTS | MALLICKRODT MEDICAL, INC. (US) | 1992-08-11 | — | — | US | claimed |
| US-5130120-A | Diethylenetriaminepentaacetic acid or ethylenediamine tetraacetic acid for magnetic resonance imaging | MALLINCKRODT MEDICAL, INC. (US) | 1992-07-14 | — | — | US | claimed |
| EP-0425571-A1 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS. | MALLINCKRODT INC (US) | 1991-05-08 | — | — | EP | claimed |
| WO-1990001024-A1 | NOVEL MAGNETIC RESONANCE IMAGING AGENTS | MALLINCKRODT, INC. (US) | 1990-02-08 | — | — | WO | claimed |
| US-10190009-B2 | Ink composition, ink jet recording method using same, and colored material | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2019-01-29 | — | — | US | disclosed |
| US-20160160065-A1 | INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2016-06-09 | — | — | US | disclosed |
| EP-3015516-A1 | INK COMPOSITION, INK JET RECORDING METHOD USING SAME, AND COLORED MATERIAL | Nippon Kayaku Kabushiki Kaisha (JP) | 2016-05-04 | — | — | EP | disclosed |
| US-20150315212-A1 | SUBSTITUTED 1,4-DITHIINE DERIVATIVES AND THEIR USE AS FUNGICIDES | BASF SE (DE) | 2015-11-05 | — | — | US | disclosed |
| EP-2928897-A1 | NEW SUBSTITUTED 1,4-DITHIINE DERIVATIVES AND THEIR USE AS FUNGICIDES | BASF SE (DE) | 2015-10-14 | — | — | EP | disclosed |
| WO-2015150139-A1 | SUBSTITUTED 1,4-DITHIINE DERIVATIVES AND THEIR USE AS FUNGICIDES | BASF SE (DE) | 2015-10-08 | — | — | WO | disclosed |
| US-20150208656-A1 | Substituted thiadiazoles and their use as fungicides | BASF SE (DE) | 2015-07-30 | — | — | US | disclosed |
| EP-2402337-A1 | Pyrazolopyridine compounds | BASF SE (DE) | 2012-01-04 | — | — | EP | disclosed |
| EP-1439169-B1 | DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR | KUMIAI CHEMICAL INDUSTRY CO (JP) | 2008-08-06 | — | — | EP | disclosed |
| US-7273878-B2 | Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2007-09-25 | — | — | US | disclosed |
| US-20040248872-A1 | Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor | IHARA CHEMICAL INDUSTRY CO., LTD. (JP) | 2004-12-09 | — | — | US | disclosed |
| EP-1439169-A1 | DIFLUOROALKENE DERIVATIVE&comma; PEST CONTROL AGENT CONTAINING THE SAME&comma; AND INTERMEDIATE THEREFOR | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2004-07-21 | — | — | EP | disclosed |
| US-4895981-A | Using ultraviolet absorber | CIBA-GEIGY CORPORATION (US) | 1990-01-23 | — | — | US | disclosed |
| EP-0173857-A1 | Fungicidal agent based on phosphoryloximinoacetamide | BAYER AG (DE) | 1986-03-12 | — | — | EP | disclosed |