SCHEMBL3280289

SCHEMBL3280289

Cc1cc(O)c(N=O)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SELL P14151 1/20 0.50
SELP P16109 1/20 0.50
SELE P16581 1/20 0.50
ACHE P22303 1/20 0.50
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
ALDH1A1 P00352 5/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TRPA1 O75762 1/20 0.40
PIM1 P11309 2/20 0.39
DAO P14920 1/20 0.38
MAPT P10636 6/20 0.37
KMT2A Q03164 5/20 0.37
KDM4E B2RXH2 3/20 0.37
POLB P06746 2/20 0.37

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
SCHEMBL3279378 0.88 GRIN2D (0.47) SELLSELPSELEACHEGRIN2D
SCHEMBL26719984 0.86 SELL (0.48) SELLSELPSELEACHEGRIN2D
Hydrochloric Acid SCHEMBL18317014 0.83 ALDH1A1 (0.42) SELLSELPSELEACHEGRIN2D
SCHEMBL2186807 0.78 CYP3A4 (0.40) ACHEL3MBTL1KMT2APOLBGAA
SCHEMBL14270464 0.74 SELL (0.38) SELLSELPSELEACHEGRIN2D
SCHEMBL1607312 0.73 GRIN2D (0.40) SELLSELPSELEGRIN2DGRIN3B
SCHEMBL13425237 0.73 SELL (0.56) SELLSELPSELEACHEGRIN2D
SCHEMBL14294447 0.73 CYP3A4 (0.54) ALDH1A1MAPTKDM4EPOLBRECQL
SCHEMBL7026232 0.72 GRIN2D (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10579030 0.70 ALDH1A1 (0.34) ACHEGRIN2DGRIN3BGRIN1GRIN2A

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 4 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
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
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-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