SCHEMBL739602

SCHEMBL739602

O=[C]NCO

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
SCHEMBL207518 0.72
SCHEMBL208475 0.69
SCHEMBL1270192 0.67
SCHEMBL737287 0.67
SCHEMBL308800 0.67
SCHEMBL10771642 0.67
SCHEMBL9303276 0.67
SCHEMBL5473399 0.67
SCHEMBL10653343 0.65
SCHEMBL5651965 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 432 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9145425-B2 Cephem compound having catechol group SHIONOGI & CO., LTD. (JP) 2015-09-29 US claimed
JP-4650419-B2 2011-03-16 JP claimed
CN-100491358-C Pyrimidinone compounds, compositions and methods CYTOKINETICS INC SMITHKLINE BE (US) 2009-05-27 CN claimed
US-7524594-B2 Photosensitive dielectric resin compositions, films formed therefrom and semiconductor and display devices encompassing such films PROMERUS LLC (US) 2009-04-28 US claimed
EP-1778759-B1 PHOTOSENSITIVE DIELECTRIC RESIN COMPOSITIONS AND THEIR USES PROMERUS LLC (US) 2008-11-12 EP claimed
US-7407961-B2 Pyrazine derivatives and pharmaceutical use thereof ASTELLAS PHARMA INC. (JP) 2008-08-05 US claimed
EP-1778759-A1 PHOTOSENSITIVE DIELECTRIC RESIN COMPOSITIONS AND THEIR USES Promerus, LLC (US) 2007-05-02 EP claimed
JP-2007510620-A 2007-04-26 JP claimed
EP-1682534-A2 PYRIMIDIN-4-ONE COMPOUNDS, COMPOSITIONS, AND METHODS Cytokinetics, Inc. (US) 2006-07-26 EP claimed
EP-1678160-A1 PYRAZINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF Astellas Pharma Inc. (JP) 2006-07-12 EP claimed
US-20050197327-A1 Compounds, compositions, and methods CYTOKINETICS, INCORPORATED 2005-09-08 US claimed
CN-1665788-A Pyrimidinone compounds, compositions and methods CYTOKINETICS INC (US) 2005-09-07 CN claimed
US-20050113387-A1 Pyrazine derivatives and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2005-05-26 US claimed
WO-2005041888-A2 PYRIMIDIN-4-ONE COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-05-12 WO claimed
WO-2005040151-A1 PYRAZINE DERIVATIVES AND PHARMACEUTICAL USE THEREOF ASTELLAS PHARMA INC. (JP) 2005-05-06 WO claimed
EP-0472925-B1 Substituted pyridins BAYER AG (DE) 1994-08-31 EP claimed
US-4801703-A PHOSPHORUS COMPOUNDS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-01-31 US claimed
EP-0102740-B1 N-FORMYL AND N-HYDROXYMETHYL-3-PHENOXY-1-AZETIDINECARBOXAMIDES AND THEIR PREPARATION AND USE A.H. ROBINS COMPANY, INCORPORATED (US) 1986-11-05 EP claimed
EP-0078266-B1 CROSS-LINKABLE POLYMER COMPOSITION SOLUBLE IN AN AQUEOUS MEDIUM, PREPARATION AND UTILIZATION THEREOF CASSELLA Aktiengesellschaft (DE) 1985-11-13 EP claimed
EP-0030030-A1 Derivatives of 2-aminoethanol, processes for their preparation, pharmaceutical compositions containing such compounds and the use the latter CIBA-GEIGY AG (CH) 1981-06-10 EP claimed