SCHEMBL3159374

SCHEMBL3159374

CC(=O)N(Cl)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
TSHR P16473 6/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.50
CES2 O00748 1/20 0.49
CES1 P23141 1/20 0.49
MAPT P10636 4/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPK1 P28482 1/20 0.48
GLO1 Q04760 1/20 0.48
TP53 P04637 1/20 0.47
ACHE P22303 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
ALOX15 P16050 1/20 0.47
HTT P42858 2/20 0.45
DDX3X O00571 1/20 0.45
POLB P06746 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45

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
SCHEMBL1815772 0.83 SMN1; SMN2 (0.47) ALDH1A1TSHRSMN1; SMN2LMNACES2
SCHEMBL6824854 0.83 TP53 (0.50) ALDH1A1TSHRSMN1; SMN2LMNACES2
SCHEMBL2017690 0.82 ALDH1A1 (0.56) ALDH1A1TSHRSMN1; SMN2LMNACES2
SCHEMBL7195191 0.82 ALDH1A1 (0.56) ALDH1A1TSHRSMN1; SMN2LMNACES2
SCHEMBL12200278 0.80 CRHBP (0.43) ALDH1A1TSHRLMNAMAPTMEN1
SCHEMBL1820229 0.80 ALDH1A1 (0.43) ALDH1A1TSHRSMN1; SMN2LMNACES2
SCHEMBL11819373 0.80 TSHR (0.57) ALDH1A1TSHRLMNACES2CES1
SCHEMBL3154682 0.80 MAPK1 (0.53) ALDH1A1TSHRCES1MAPTMEN1
SCHEMBL8761430 0.79 ALDH1A1 (0.53) ALDH1A1TSHRSMN1; SMN2LMNACES2
SCHEMBL28165474 0.78 ALDH1A1 (0.47) ALDH1A1TSHRSMN1; SMN2LMNACES2

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1749880-B1 Cleaning compositions and methods RECKITT BENCKISER UK LTD (GB) 2013-04-17 EP disclosed
US-8258092-B2 Cleaning compositions and methods RECKITT BENCKISER (UK) LIMITED (GB) 2012-09-04 US disclosed
CN-1989233-B Improvement of cleaning or relating to cleaning RECKITT BENCKISER UK LTD (GB) 2011-01-12 CN disclosed
EP-2157161-A1 Improvements in or relating to cleaning Reckitt-Benckiser (UK) Limited (GB) 2010-02-24 EP disclosed
US-7638470-B2 Cleaning RECKITT BENCKISER (UK) LIMITED (GB) 2009-12-29 US disclosed
EP-1771537-B1 IMPROVEMENTS IN OR RELATING TO CLEANING RECKITT BENCKISER UK LTD (GB) 2009-12-16 EP disclosed
US-20080230095-A1 Cleaning Compositions and Methods RECKITT BENCKISER (UK) LIMITED (GB) 2008-09-25 US disclosed
US-20070254824-A1 Multicompartment container for a liquid cleaning compound in combination with a solid oxidation catalyst which when in contact with the cleaner causes a reaction to increase its oxidation power, or change its pH, cause gas evolution, or release heat; antisoilants; tough stains; fabrics; surfaces RECKITT BENCKISER (UK) LIMITED (GB) 2007-11-01 US disclosed
CN-1989233-A Liquid cleaning composition, catalyst therefor and methods of cleaning RECKITT BENCKISER UK LTD (GB) 2007-06-27 CN disclosed
EP-1360270-B1 AUTOMATIC DISHWASHING COMPOSITIONS COMPRISING BLOOMING PERFUME AND BASE MASKING INGREDIENTS PROCTER & GAMBLE (US) 2007-05-16 EP disclosed
EP-0888446-B1 TOILET BOWL DETERGENT SYSTEM CONTAINING BLOOMING PERFUME PROCTER & GAMBLE (US) 2003-10-15 EP disclosed
US-20020169091-A1 Automatic dishwashing compositions comprising blooming perfume and base masking ingredients PROCTER & GAMBLE COMPANY, THE 2002-11-14 US disclosed
WO-2002064723-A2 AUTOMATIC DISHWASHING COMPOSITIONS COMPRISING BLOOMING PERFUME AND BASE MASKING INGREDIENTS THE PROCTER & GAMBLE COMPANY (US) 2002-08-22 WO disclosed
US-6143707-A CLEANING AND STAIN REMOVAL AND PROVIDE A POSITIVE SCENT; FOR WASHING KITCHENWARE THE PROCTER & GAMBLE COMPANY (US) 2000-11-07 US disclosed
US-6001789-A BLOCK DETERGENT COMPRISING MOISTURE ACTIVATED ENCAPSULATED PERFUME PARTICLES, SURFACTANT, DETERGENT BUILDER AND SYSTEM FOR PROVIDING CONCENTRATION OF CLEANING COMPOUND TO TOILET WATER THE PROCTER & GAMBLE COMPANY (US) 1999-12-14 US disclosed
EP-0888441-A1 BUILT AUTOMATIC DISHWASHING COMPOSITIONS COMPRISING BLOOMING PERFUME THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 EP disclosed
EP-0888446-A1 TOILET BOWL DETERGENT SYSTEM CONTAINING BLOOMING PERFUME THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 EP disclosed
WO-1997034987-A1 BUILT AUTOMATIC DISHWASHING COMPOSITIONS COMPRISING BLOOMING PERFUME THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO disclosed
WO-1997034993-A1 TOILET BOWL DETERGENT SYSTEM CONTAINING BLOOMING PERFUME THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO disclosed
WO-1997007188-A1 HAND DISHWASHING POWDER WITH CHLORINE BLEACH THE PROCTER & GAMBLE COMPANY (US) 1997-02-27 WO disclosed