Butadiene

Butadiene

SCHEMBL896495

C=CC=C.COc1cnccn1

nearest known ligand 0.43

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
MEN1 O00255 1/20 0.34
PLAU P00749 1/20 0.34
HSP90AA1 P07900 1/20 0.33
DYRK1A Q13627 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
SIRT6 Q8N6T7 1/20 0.32
LOX P28300 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32

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
SCHEMBL391812 0.89
SCHEMBL29445963 0.89
SCHEMBL13359011 0.89 MAPT (0.45) MAPTKDM4ESMN1; SMN2KMT2AHTT
Formaldehyde SCHEMBL27596059 0.87 MAPT (0.45) MAPTKDM4ESMN1; SMN2KMT2AHTT
Ammonia Solution, Strong SCHEMBL28148961 0.87
Ethane SCHEMBL5007888 0.87 MAPT (0.44) MAPTKDM4ESMN1; SMN2KMT2AHTT
Ammonia Solution, Strong SCHEMBL27633176 0.85 MAPT (0.42) MAPTKDM4ESMN1; SMN2KMT2AHTT
Isobutane SCHEMBL996078 0.83 MAPT (0.41) MAPTKDM4ESMN1; SMN2KMT2AHTT
Formamide SCHEMBL446005 0.82 MAPT (0.49) MAPTKDM4ESMN1; SMN2KMT2AHTT
Butane SCHEMBL18670328 0.81 MAPT (0.41) MAPTKDM4ESMN1; SMN2KMT2AHTT

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 141 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-12525649-B2 Cyclic sulfone additives for lithium ion batteries Sionic Energy, Inc. (US) 2026-01-13 US disclosed
US-12327844-B2 Materials to improve the performance of lithium and sodium batteries UCHICAGO ARGONNE, LLC (US) 2025-06-10 US disclosed
EP-4562705-A2 FUNCTIONALIZED CROWN ETHERS FOR LITHIUM-ION BATTERIES Sionic Energy, Inc. (US) 2025-06-04 EP disclosed
EP-4562704-A2 MODIFIED DOPO-BASED BATTERY ELECTROLYTES Sionic Energy, Inc. (US) 2025-06-04 EP disclosed
EP-3656010-B1 PHOSPHORUS-CONTAINING ELECTROLYTES SIONIC ENERGY INC (US) 2025-03-26 EP disclosed
CN-119605011-A Functionalized crown ethers for lithium ion batteries 西奥尼克能源公司 2025-03-11 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