SCHEMBL2148444

SCHEMBL2148444

CC(C)(CCC(=O)O)CC(=O)OC(=O)CC(C)(C)CCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.45
CPT2 P23786 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
NAALAD2 Q9Y3Q0 1/20 0.39
TBXAS1 P24557 2/20 0.38
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
THRB P10828 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR1 P03372 1/20 0.36
CYP3A4 P08684 1/20 0.36
ESR2 Q92731 1/20 0.36
HMGCR P04035 1/20 0.36
CHRM1 P11229 1/20 0.36
TBXA2R P21731 1/20 0.36
ADRA1A P35348 1/20 0.36
TSHR P16473 3/20 0.35
KDM4E B2RXH2 1/20 0.35
HIF1A Q16665 2/20 0.34

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
SCHEMBL2147926 0.88 TDP1 (0.52) FFAR1CPT2TDP1TBXAS1ALDH1A1
Sebacic Acid SCHEMBL28078193 0.83 TDP1 (0.47) FFAR1CPT2TDP1ALDH1A1MEN1
SCHEMBL46812 0.82 GAA (0.41) FFAR1CPT2TDP1NAALAD2TBXAS1
SCHEMBL2203104 0.81 FFAR1 (0.65) FFAR1CPT2TDP1NAALAD2TBXAS1
SCHEMBL18789275 0.80 FFAR1 (0.40) FFAR1CPT2TDP1NAALAD2TBXAS1
SCHEMBL194853 0.79 KDM4E (0.50) FFAR1CPT2TDP1ALDH1A1HMGCR
SCHEMBL11529406 0.78 NAALAD2 (0.50) FFAR1CPT2TDP1NAALAD2TBXAS1
Hydrochloric Acid SCHEMBL31279551 0.76 NAALAD2 (0.48) FFAR1CPT2TDP1NAALAD2TBXAS1
SCHEMBL28695620 0.74 TSHR (0.56) FFAR1CPT2TDP1NAALAD2TBXAS1
SCHEMBL13168811 0.74 NAALAD2 (0.46) FFAR1CPT2TDP1NAALAD2TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3103155-B1 SPECIFIC LITHIUM BATTERIES COMPRISING NON-AQUEOUS ELECTROLYTES BASED ON SULFONE COMPOUNDS RENAULT SAS (FR) 2017-11-22 EP claimed
US-20160359199-A1 SPECIFIC LITHIUM BATTERIES COMPRISING NON-AQUEOUS ELECTROLYTES BASED ON SULFONE COMPOUNDS RENAULT S.A.S (FR) 2016-12-08 US claimed
CN-106104895-A Specific lithium battery comprising a non-aqueous electrolyte based on sulfone compounds 雷诺两合公司 2016-11-09 CN claimed
US-20110171539-A1 Non-Aqueous Electrolyte for a High-Voltage Lithium Battery COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2011-07-14 US claimed
US-20160359199-A1 SPECIFIC LITHIUM BATTERIES COMPRISING NON-AQUEOUS ELECTROLYTES BASED ON SULFONE COMPOUNDS RENAULT S.A.S (FR) 2016-12-08 US disclosed
CN-106104895-A Specific lithium battery comprising a non-aqueous electrolyte based on sulfone compounds 雷诺两合公司 2016-11-09 CN disclosed
US-20150125762-A1 LITHIUM ELECTROCHEMICAL STORAGE BATTERY OF THE LITHIUM/AIR TYPE COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2015-05-07 US disclosed
US-8679686-B2 Non-aqueous electrolyte for a high-voltage lithium battery COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2014-03-25 US disclosed
US-20110171539-A1 Non-Aqueous Electrolyte for a High-Voltage Lithium Battery COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2011-07-14 US disclosed