SCHEMBL1733865

SCHEMBL1733865

C[C]1CCOO1

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL11821396 0.81
SCHEMBL4722582 0.63
SCHEMBL329904 0.62
SCHEMBL322386 0.62
SCHEMBL4912264 0.61
SCHEMBL7047951 0.60
SCHEMBL2224005 0.56
SCHEMBL73036 0.53
SCHEMBL1351735 0.52
Fluoride SCHEMBL28800872 0.52

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 54 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018141541-A1 COMPOUND FOR IN VIVO DIAGNOSIS OF A DYSFUNCTION OF ADRENAL GLANDS JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2018-08-09 WO claimed
EP-3357910-A1 COMPOUND FOR IN VIVO DIAGNOSIS OF A DYSFUNCTION OF ADRENAL GLANDS Julius-Maximilians-Universität Würzburg (DE) 2018-08-08 EP claimed
EP-1954287-B2 CETP INHIBITORS MERCK SHARP & DOHME (US) 2016-02-24 EP claimed
US-20140343085-A1 USE OF ARYL DERIVATIVES FOR CONTROLLING ECTOPARASITES NOVARTIS AG (CH) 2014-11-20 US claimed
EP-2785341-A1 ARYL DERIVATIVES FOR CONTROLLING ECTOPARASITES Novartis AG (CH) 2014-10-08 EP claimed
WO-2013079407-A1 ARYL DERIVATIVES FOR CONTROLLING ECTOPARASITES NOVARTIS AG (CH) 2013-06-06 WO claimed
EP-1954287-B1 CETP INHIBITORS MERCK SHARP & DOHME (US) 2011-11-16 EP claimed
EP-1658263-B9 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2011-11-09 EP claimed
US-20110262658-A1 PROCESS AND DEVICE FOR TREATING THE COATING OF THERMOPLASTIC RESIN CONTAINERS ZOPPAS MATTEO 2011-10-27 US claimed
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US claimed
EP-1658263-B1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2010-06-02 EP claimed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US claimed
EP-1954287-A2 CETP INHIBITORS Merck & Co., Inc. (US) 2008-08-13 EP claimed
WO-2007070173-A2 CETP INHIBITORS MERCK & CO., INC. (US) 2007-06-21 WO claimed
JP-2006528597-A 2006-12-21 JP claimed
US-20060166990-A1 Novel aminobenzophenone compounds LEO PHARMA A/S (DK) 2006-07-27 US claimed
EP-1658263-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS Leo Pharma A/S (DK) 2006-05-24 EP claimed
WO-2005009940-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA A/S (DK) 2005-02-03 WO claimed
US-3968232-A INSECTICIDE, ACARICIDE, NEMATOCIDE, FUNGICIDE, BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-07-06 US claimed
WO-2018141541-A1 COMPOUND FOR IN VIVO DIAGNOSIS OF A DYSFUNCTION OF ADRENAL GLANDS JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2018-08-09 WO disclosed
WO-2018141541-A1 COMPOUND FOR IN VIVO DIAGNOSIS OF A DYSFUNCTION OF ADRENAL GLANDS JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2018-08-09 WO disclosed
EP-3357910-A1 COMPOUND FOR IN VIVO DIAGNOSIS OF A DYSFUNCTION OF ADRENAL GLANDS Julius-Maximilians-Universität Würzburg (DE) 2018-08-08 EP disclosed
EP-3357910-A1 COMPOUND FOR IN VIVO DIAGNOSIS OF A DYSFUNCTION OF ADRENAL GLANDS Julius-Maximilians-Universität Würzburg (DE) 2018-08-08 EP disclosed
EP-1954287-B2 CETP INHIBITORS MERCK SHARP & DOHME (US) 2016-02-24 EP disclosed
US-20140343085-A1 USE OF ARYL DERIVATIVES FOR CONTROLLING ECTOPARASITES NOVARTIS AG (CH) 2014-11-20 US disclosed
EP-2785341-A1 ARYL DERIVATIVES FOR CONTROLLING ECTOPARASITES Novartis AG (CH) 2014-10-08 EP disclosed
WO-2014090918-A1 PROCESS FOR THE ENANTIOMERIC ENRICHMENT OF DIARYLOXAZOLINE DERIVATIVES NOVARTIS AG (CH) 2014-06-19 WO disclosed
WO-2013079407-A1 ARYL DERIVATIVES FOR CONTROLLING ECTOPARASITES NOVARTIS AG (CH) 2013-06-06 WO disclosed
EP-1854792-B1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2012-12-26 EP disclosed
US-8334290-B2 CETP inhibitors MERCK SHARP & DOHME CORP. (US) 2012-12-18 US disclosed
EP-1954287-B1 CETP INHIBITORS MERCK SHARP & DOHME (US) 2011-11-16 EP disclosed
EP-1658263-B9 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2011-11-09 EP disclosed
US-20110262658-A1 PROCESS AND DEVICE FOR TREATING THE COATING OF THERMOPLASTIC RESIN CONTAINERS ZOPPAS MATTEO 2011-10-27 US disclosed
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US disclosed
US-7820693-B2 1-(2H)-isoquinolone derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2010-10-26 US disclosed
EP-1658263-B1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2010-06-02 EP disclosed
US-20090264405-A1 Cetp Inhibitors MERCK SHARP & DOHME LLC 2009-10-22 US disclosed
US-20090030195-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2009-01-29 US disclosed
EP-1954287-A2 CETP INHIBITORS Merck & Co., Inc. (US) 2008-08-13 EP disclosed
EP-1854792-A1 1-(2H)-ISOQUINOLONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2007-11-14 EP disclosed
WO-2007070173-A2 CETP INHIBITORS MERCK & CO., INC. (US) 2007-06-21 WO disclosed
US-20060166990-A1 Novel aminobenzophenone compounds LEO PHARMA A/S (DK) 2006-07-27 US disclosed
EP-1658263-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS Leo Pharma A/S (DK) 2006-05-24 EP disclosed
WO-2005009940-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA A/S (DK) 2005-02-03 WO disclosed
US-20040097522-A1 Triazolopyrimidines BAYER CROPSCIENCE AG (DE) 2004-05-20 US disclosed
EP-1349859-A2 TRIAZOLOPYRIMIDINES Bayer CropScience AG (DE) 2003-10-08 EP disclosed
WO-2002050077-A2 TRIAZOLOPYRIMIDINES BAYER CROPSCIENCE AG (DE) 2002-06-27 WO disclosed
WO-1996000219-A1 PYRIMIDINYL- AND TRIAZINYL-OXY AND THIO-3-HALOALKYL-PROPIONIC ACID DERIVATIVES AS HERBICIDES CIBA-GEIGY AG (CH) 1996-01-04 WO disclosed
US-5455355-A Postemergence, preemergence herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-10-03 US disclosed
US-5298632-A Herbicidal pyrimidine compounds, compositions containing the same and method of use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-03-29 US disclosed
US-5232897-A Herbicidal pyrimidine compounds, compositions containing the same and method of use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-03 US disclosed
EP-0457505-A2 Pyrimidine derivatives and their use as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-11-21 EP disclosed
US-3968232-A INSECTICIDE, ACARICIDE, NEMATOCIDE, FUNGICIDE, BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-07-06 US disclosed
US-3968232-A INSECTICIDE, ACARICIDE, NEMATOCIDE, FUNGICIDE, BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-07-06 US disclosed
US-3968232-A INSECTICIDE, ACARICIDE, NEMATOCIDE, FUNGICIDE, BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-07-06 US disclosed