SCHEMBL897958

SCHEMBL897958

CCCCCOc1ncc[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.49
CYP2D6 P10635 5/20 0.49
CYP1A2 P05177 3/20 0.49
CYP2C9 P11712 3/20 0.49
CYP2C19 P33261 3/20 0.49
CYP19A1 P11511 2/20 0.49
CDK1 P06493 2/20 0.37
CCNB1 P14635 2/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCNA1 P78396 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
NR5A1 Q13285 1/20 0.36
LTA4H P09960 2/20 0.35
TLR8 Q9NR97 2/20 0.35
XDH P47989 2/20 0.35
LMNA P02545 3/20 0.34
NPC1 O15118 2/20 0.34
NFKB1 P19838 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
SCHEMBL4268381 0.94 CYP2D6 (0.54) CYP3A4CYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL4265557 0.88
SCHEMBL3454835 0.79
SCHEMBL9181515 0.78 XDH (0.43) CYP3A4SMN1; SMN2ALDH1A1XDHLMNA
SCHEMBL27532148 0.78 ALDH1A1 (0.38) CYP3A4CYP2D6CYP1A2CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL28209887 0.77
SCHEMBL11168596 0.75 CYP1A2 (0.39) CYP3A4CYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL29745145 0.75
SCHEMBL28850765 0.74 CYP1A2 (0.44) CYP3A4CYP2D6CYP1A2CYP2C9CYP2C19
SCHEMBL1691753 0.74 CDK1 (0.41) CYP3A4CYP2D6CYP1A2CYP2C9CYP2C19

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 116 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
EP-4158671-A2 MODIFIED IONIC LIQUIDS CONTAINING BICYCLOPHOSPHATE MOIETY Nohms Technologies, Inc. (US) 2023-04-05 EP disclosed
CN-110892568-B Modified triazine functional compounds 诺姆斯科技公司 2023-03-31 CN 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
WO-2007062332-A2 NOVEL INTERMEDIATES AND THEIR USE GLAXO GROUP LIMITED (GB) 2007-05-31 WO 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