Butadiene

Butadiene

SCHEMBL896449

C=CC=C.O=C(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALOX15 P16050 2/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MAPT P10636 3/20 0.43
ALDH1A1 P00352 2/20 0.43
THRB P10828 1/20 0.43
KMT2A Q03164 2/20 0.42
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
TGM2 P21980 1/20 0.42
RAD51 Q06609 1/20 0.42
AKT1 P31749 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NSD2 O96028 1/20 0.41
USP2 O75604 1/20 0.41

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
Acrylic Acid SCHEMBL6692818 0.89 THRB (0.46) TDP1ATML3MBTL1ALOX15HPGD
Ethylene SCHEMBL2021059 0.88 TDP1 (0.50) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL9353461 0.88 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL9353455 0.88 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL18073 0.88 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL27352197 0.88 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL9241160 0.88 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HPGD
Bicarbonate SCHEMBL28174005 0.86 TDP1 (0.48) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL1624304 0.85 KMT2A (0.52) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL10945396 0.85 TDP1 (0.52) TDP1ATML3MBTL1ALOX15HPGD

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 98 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
US-11575125-B2 Patterned anode for lithium-ion batteries UCHICAGO ARGONNE, LLC (US) 2023-02-07 US disclosed
EP-4106070-A1 PHOSPHORUS-CONTAINING ELECTROLYTES Nohms Technologies, Inc. (US) 2022-12-21 EP disclosed
US-11489201-B2 Modified ionic liquids containing phosphorus NOHMs Technologies, Inc. (US) 2022-11-01 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11489201-B2 Modified ionic liquids containing phosphorus INPPL1, PLCB3, INPP5D TDP1 1328/4885ATM 753/4885L3MBTL1 878/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.