SCHEMBL898044

SCHEMBL898044

CCCCCOc1coc(C(=O)O)c1CC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
PLA2G2A P14555 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
PLA2G4B P0C869 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
S1PR3 Q99500 1/20 0.40
PTPN11 Q06124 1/20 0.40
RARB P10826 3/20 0.39
NR1I2 O75469 1/20 0.39
LMNA P02545 1/20 0.39
CHRM2 P08172 1/20 0.39
CYP3A4 P08684 1/20 0.39
ADRA2A P08913 1/20 0.39
MAPT P10636 1/20 0.39
OPRK1 P41145 1/20 0.39
HTR2B P41595 1/20 0.39

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
SCHEMBL898252 0.75 ALDH1A1 (0.49) MEN1KMT2ATDP1TP53TSHR
SCHEMBL4956492 0.74 ALDH1A1 (0.51) MEN1KMT2ATDP1TP53TSHR
SCHEMBL10328605 0.72 MEN1 (0.48) MEN1KMT2ATDP1PLA2G2ATP53
SCHEMBL5599077 0.71 SMN1; SMN2 (0.34) KMT2ATDP1TP53TSHRALDH1A1
SCHEMBL10494168 0.71 MEN1 (0.50) MEN1KMT2ATDP1PLA2G2ATP53
SCHEMBL10328548 0.71 MEN1 (0.50) MEN1KMT2ATDP1PLA2G2ATP53
SCHEMBL11562652 0.70 TSHR (0.43) TP53TSHRALDH1A1LMNACYP3A4
SCHEMBL8167721 0.68 PTPN11 (0.61) PLA2G2ATP53TSHRPLA2G4BS1PR3
SCHEMBL668868 0.68 PLA2G2A (0.50) MEN1KMT2ATDP1PLA2G2ATP53
Hydrochloric Acid SCHEMBL9038246 0.67 PTPN11 (0.60) PLA2G2ATP53TSHRPLA2G4BS1PR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9184428-B2 Non-aqueous electrolytes for lithium ion batteries UCHICAGO ARGONNE LLC (US) 2015-11-10 US claimed
US-9012096-B2 Long life lithium batteries with stabilized electrodes UCHICAGO ARGONNE, LLC (US) 2015-04-21 US claimed
US-7851092-B2 Redox shuttles for overcharge protection of lithium batteries U CHICAGO ARGONNE LLC (US) 2010-12-14 US claimed
WO-2006101779-A2 NON-AQUEOUS ELECTROLYTES FOR LITHIUM ION BATTERIES THE UNIVERSITY OF CHICAGO (US) 2006-09-28 WO claimed
US-20060210883-A1 Non-aqueous electrolytes for lithium ion batteries THE UNIVERSITY OF CHICAGO 2006-09-21 US claimed
WO-2006094069-A2 NOVEL REDOX SHUTTLES FOR OVERCHARGE PROTECTION OF LITHIUM BATTERIES UCHICAGO ARGONNE, LLC (US) 2006-09-08 WO claimed
US-20060199080-A1 Novel redox shuttles for overcharge protection of lithium batteries THE UNIVERSITY OF CHICAGO 2006-09-07 US claimed
US-20060147809-A1 Non-aqueous electrolyte of an alkali metal salt, a polar aprotic solvent, and an electrode stabilization additive comprising a linear, branched or cyclic hydrocarbon, other than a spirocyclic hydrocarbon, comprising at least one oxygen atom and at least one aryl, alkenyl or alkynyl group THE UNIVERSITY OF CHICAGO 2006-07-06 US claimed
US-12021226-B2 Cathode materials for secondary batteries UCHICAGO ARGONNE, LLC (US) 2024-06-25 US disclosed
EP-3656009-B1 MODIFIED IONIC LIQUIDS CONTAINING TRIAZINE NOHMS TECH INC (US) 2023-11-15 EP disclosed
CN-110915037-B Electrolyte containing phosphorus 诺姆斯科技公司 2023-11-07 CN disclosed
EP-4158671-A2 MODIFIED IONIC LIQUIDS CONTAINING BICYCLOPHOSPHATE MOIETY Nohms Technologies, Inc. (US) 2023-04-05 EP disclosed
US-11575125-B2 Patterned anode for lithium-ion batteries UCHICAGO ARGONNE, LLC (US) 2023-02-07 US disclosed
CN-115668422-A Modified ionic liquids containing a bicyclic phosphate moiety 诺姆斯科技股份有限公司 2023-01-31 CN disclosed
US-20070148545-A1 Electrode materials and lithium battery systems THE UNIVERSITY OF CHICAGO 2007-06-28 US disclosed
WO-2006101779-A2 NON-AQUEOUS ELECTROLYTES FOR LITHIUM ION BATTERIES THE UNIVERSITY OF CHICAGO (US) 2006-09-28 WO disclosed
US-20060210883-A1 Non-aqueous electrolytes for lithium ion batteries THE UNIVERSITY OF CHICAGO 2006-09-21 US disclosed
WO-2006094069-A2 NOVEL REDOX SHUTTLES FOR OVERCHARGE PROTECTION OF LITHIUM BATTERIES UCHICAGO ARGONNE, LLC (US) 2006-09-08 WO disclosed
US-20060199080-A1 Novel redox shuttles for overcharge protection of lithium batteries THE UNIVERSITY OF CHICAGO 2006-09-07 US disclosed
US-20060147809-A1 Non-aqueous electrolyte of an alkali metal salt, a polar aprotic solvent, and an electrode stabilization additive comprising a linear, branched or cyclic hydrocarbon, other than a spirocyclic hydrocarbon, comprising at least one oxygen atom and at least one aryl, alkenyl or alkynyl group THE UNIVERSITY OF CHICAGO 2006-07-06 US disclosed