SCHEMBL3279880

SCHEMBL3279880

O=C(O)c1cccnc1C(=O)NO

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.69
ALDH1A1 P00352 3/20 0.69
L3MBTL1 Q9Y468 2/20 0.69
CYP3A4 P08684 1/20 0.69
MAPT P10636 1/20 0.69
ALOX15 P16050 1/20 0.69
TSHR P16473 1/20 0.69
BLM P54132 1/20 0.69
AGER Q15109 1/20 0.69
NPSR1 Q6W5P4 1/20 0.69
TDP1 Q9NUW8 1/20 0.55
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
NAPRT Q6XQN6 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 1/20 0.52
DHODH Q02127 3/20 0.49
GAA P10253 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47

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
SCHEMBL8328679 0.89 KDM4E (0.54) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
SCHEMBL11825890 0.84 KDM4E (0.67) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
SCHEMBL20886582 0.84 KDM4E (0.67) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
SCHEMBL5902495 0.84 PARP1 (0.50) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
Quinolinic Acid SCHEMBL29356188 0.82 KDM4E (1.00) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
Quinolinic Acid SCHEMBL27676801 0.82 KDM4E (1.00) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
Quinolinic Acid SCHEMBL343618 0.82 KDM4E (1.00) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
Quinolinic Acid SCHEMBL69230 0.82 KDM4E (1.00) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
SCHEMBL9130938 0.81 KDM4E (0.52) KDM4EALDH1A1L3MBTL1CYP3A4MAPT
SCHEMBL10336997 0.80 ALDH1A1 (0.80) KDM4EALDH1A1L3MBTL1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-6316639-B1 REACTING DICARBOXYLIC ACIDS OR ANHYDRIDES WITH A SALT OF HYDROXYL-AMINE IN SOLUTION SELECTED FROM HYDROXYLAMINE SULFATE, HYDROXYLAMINE NITRATE, HYDROXYLAMINE ACETATE, HYDROXYLAMINE TETRAFLUOROBORATE, HYDROXYLAMINE PHOSPHATE Consortium für elektrochemische Industrie GmbH (DE) 2001-11-13 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