SCHEMBL9769255

SCHEMBL9769255

C=CC(=O)OC(=O)OC(=O)C=C.[NaH].[NaH]

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.40
ALDH1A1 P00352 8/20 0.40
TP53 P04637 3/20 0.40
HIF1A Q16665 3/20 0.40
CYP3A4 P08684 2/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 1/20 0.37
MAPK1 P28482 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 1/20 0.36
FGFR4 P22455 1/20 0.35
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL28051256 0.97 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL996109 0.97 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9245797 0.94 TSHR (0.40) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27914574 0.91 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylamide SCHEMBL27744821 0.89 TSHR (0.55) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL7076062 0.87 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL10429566 0.86 LMNA (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20360012 0.86 TSHR (0.36) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL27987249 0.84 TSHR (0.42) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL278164 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3230009-A None JP disclosed
CN-109650430-A A kind of method of high content of magnesium lime stone preparation nanometer calcium carbonate 广西华纳新材料科技有限公司 2019-04-19 CN disclosed
CN-101679170-B Ether compound KAO CORP 2013-05-22 CN disclosed
CN-102143815-A Cover plate for perforating printed circuit board, water-soluble lubricating resin composition for use therein, and process for producing the same SANG A FLONTEC CO LTD 2011-08-03 CN disclosed
CN-101808709-A Filter element and filter unit TORAY INDUSTRIES 2010-08-18 CN disclosed
CN-100486555-C Automatic urine disposal device and urine receptacle used therefor HITACHI LTD (JP) 2009-05-13 CN disclosed
CN-100444015-C Liquid for electrophoretic display, display medium using the same, and display device MITSUBISHI PENCIL CO (JP) 2008-12-17 CN disclosed
CN-100396263-C Auxiliary pad for mounting absorbable article UNI CHARM CORP (JP) 2008-06-25 CN disclosed
CN-1306923-C Absorptive article DAIO SEISHI KK (JP) 2007-03-28 CN disclosed
CN-1846165-A Liquid for electrophoretic display, display medium using the same, and display device MITSUBISHI PENCIL CO (JP) 2006-10-11 CN disclosed
CN-1697620-A Method and device for manufacturing sound absorbing carpet DAIWA KK (JP) 2005-11-16 CN disclosed
CN-1688271-A Auxiliary pad for mounting absorbable article UNI CHARM CORP (JP) 2005-10-26 CN disclosed
CN-1674843-A Absorptive article DAIO SEISHI KK (JP) 2005-09-28 CN disclosed
CN-1602825-A Automatic urine disposal device and urine receptacle used therefor HITACHI LTD (JP) 2005-04-06 CN disclosed
CN-1192888-A Infant's short pants for exercitation UNI CHARM CORP (JP) 1998-09-16 CN disclosed
JP-H03230009-A FIXED TANK FOR KEROSENE HEATER MATSUSHITA ELECTRIC IND CO LTD 1991-10-14 JP disclosed