SCHEMBL3279075

SCHEMBL3279075

CC(=O)CC(=O)N(O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
ALDH1A1 P00352 4/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
GLA P06280 1/20 0.42
TSHR P16473 1/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
TP53 P04637 2/20 0.42
CTDSP1 Q9GZU7 1/20 0.41
MAPT P10636 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PIN1 Q13526 1/20 0.40
MEN1 O00255 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL4619345 0.82 ALDH1A1 (0.59) MTNR1AMTNR1BALDH1A1NPC1RAB9A
SCHEMBL9411919 0.82 MTNR1A (0.46) MTNR1AMTNR1BALDH1A1NPC1RAB9A
SCHEMBL10718969 0.81 ALDH1A1 (0.47) ALDH1A1NPC1RAB9AKMT2APOLB
SCHEMBL6659655 0.80 KMT2A (0.53) ALDH1A1NPSR1KMT2APOLBHTT
SCHEMBL3285069 0.79 ALDH1A1 (0.50) ALDH1A1NPC1RAB9ANPSR1KMT2A
SCHEMBL7985994 0.79 ALDH1A1 (0.48) ALDH1A1NPC1RAB9ANPSR1KMT2A
SCHEMBL28587375 0.78 MTNR1A (0.43) MTNR1AMTNR1BALDH1A1NPC1RAB9A
SCHEMBL10397858 0.78 CRHBP (0.46) MTNR1AMTNR1BALDH1A1NPC1RAB9A
SCHEMBL4334073 0.78 ALDH1A1 (0.46) MTNR1AMTNR1BALDH1A1NPC1RAB9A
SCHEMBL11689440 0.78 MTNR1A (0.43) MTNR1AMTNR1BALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0825294-B2 Multicomponent system for modifying, decomposing or bleaching lignin, or lignin-containing materials and method of using this system CONSORTIUM ELEKTROCHEM IND (DE) 2005-02-09 EP claimed
US-20010018956-A1 Multi-component system for modifying, degrading or bleaching lignin, lignin-containing materials or similar substances and processes for its use CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH 2001-09-06 US claimed
EP-0825294-B1 Multicomponent system for modifying, decomposing or bleaching lignin, or lignin-containing materials and method of using this system CONSORTIUM ELEKTROCHEM IND (DE) 1999-09-15 EP claimed
US-7700196-B2 Method for producing carbonyl group-containing organosilicon compounds WACKER CHEMIE AG (DE) 2010-04-20 US disclosed
CN-100528937-C Method for producing carbonyl rest-containing organosilicon compounds WACKER CHEMIE GMBH (DE) 2009-08-19 CN disclosed
US-20070129520-A1 High yield of 2-formylethyldimethylsilanol-modified polydimethylsiloxane obtained by the continuous process of oxidizing 3-hydroxypropyldimethylsilanol-modified corresponding polymer using Tempoas an oxidation catalyst and air or oxygen as oxidizer in an aqueous dispersion; industrial scale; low cost WACKER CHEMIE AG (DE) 2007-06-07 US disclosed
CN-1906230-A Method for producing carbonyl group-containing organosilicon compound WACKER CHEMIE GMBH (DE) 2007-01-31 CN disclosed
US-20060217281-A1 Oxidation system containing a macrocyclic metal complex, the production thereof and its use LANXESS B.V. (NL) 2006-09-28 US disclosed
CN-1761787-A Oxidation system comprising macrocyclic metal complexes, method for the production and use thereof LANXESS B V (NL) 2006-04-19 CN disclosed
CN-1102974-C Multi-component system for modifying, degrading or bleaching lignin, lignin-containing materials or similar substances and processes for its use CONSORTIUM ELEKTROCHEM IND (DE) 2003-03-12 CN disclosed
US-6297403-B1 OXIDATION OF A (DI)ARYL METHANE OR METHYLENE DERIVATIVE IN PRESENCE OF AN AMINE OXIDE OR HYDROXYAMINE DERIVATIVE MEDIATOR; BY-PRODUCT INHIBITION Consortium für elektrochemische Industrie GmbH (DE) 2001-10-02 US disclosed
US-20010018956-A1 Multi-component system for modifying, degrading or bleaching lignin, lignin-containing materials or similar substances and processes for its use CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH 2001-09-06 US disclosed
US-6258209-B1 DELIGNIFICATION; POLLUTION CONTROL Consortium für elektrochemische Industrie GmbH (DE) 2001-07-10 US disclosed
US-6242245-B1 DELIGNIFICATION BY ADDING SUSPENSION OF LACCASE, OXIDANT, MEDIATOR SUCH AS VIOLURIC ACID, AND XYLANASE TO AQUEOUS SUSPENSION OF LIGNIN MATERIAL AND MIXING; MEDIATOR DOES NOT DEACTIVATE ENZYME Consortium für elektrochemische Industrie GmbH (DE) 2001-06-05 US disclosed
US-6187170-B1 SYSTEM FOR THE ELECTROCHEMICAL CLEAVAGE OF COMPOUNDS WHICH INCLUDES A MEDIATOR AND AT LEAST TWO ELECTRODES FOR THE ELECTROCHEMICAL ACTIVATION OF THE MEDIATOR Consortium für elektrochemische Industrie GmbH (DE) 2001-02-13 US disclosed
US-6169213-B1 REACTING A HETEROARYL METHANOL WITH AN OXIDANT AND A MEDIATOR CONTAINING AMINO OXIDE GROUP TO FORM HETEROARYL ALDEHYDE OR A HETEROARYL KETONE Consortium f{umlaut over (u)}r elektrochemische Industrie GmbH (DE) 2001-01-02 US disclosed
US-6069282-A REACTION OF VINYL-, ALKYNYL- OR ARYL-METHANOLS WITH THE AID OF A MEDIATOR AND AN OXIDANT, WHEREIN THE MEDIATOR IS SELECTED FROM THE GROUP OF THE ALIPHATIC, CYCLOALIPHATIC, HETEROCYCLIC OR AROMATIC NO OR NOH CONTAINING COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 2000-05-30 US disclosed
US-6023000-A Process for the preparation of aldehydes and ketones Consortium fur elektrochemisch Industrie GmbH (DE) 2000-02-08 US disclosed
CN-1205366-A System for electrochemical delignification of lignincontaining materials and process for its application CONSORTIUM FURE ELEKTROCHEMISC (DE) 1999-01-20 CN disclosed
CN-1189556-A Multi-component system for modifying, degrading or bleaching lignin, lignin-containing materials or similar substances and processes for its use CONSORTIUM ELEKTROCHEM IND (DE) 1998-08-05 CN disclosed