SCHEMBL94007

SCHEMBL94007

C=C(C)C(=O)OCC1CO1.C=C(C=CC#N)C(=O)OCCCC

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
TSHR P16473 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.36
ATM Q13315 1/20 0.35
HPGD P15428 1/20 0.33
THRB P10828 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
HCAR2 Q8TDS4 1/20 0.32
TP53 P04637 2/20 0.32
CYP3A4 P08684 1/20 0.32
POLB P06746 1/20 0.31
APEX1 P27695 1/20 0.31
HTT P42858 1/20 0.31

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
Itaconate SCHEMBL10777838 0.92 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2
SCHEMBL195161 0.86 ALDH1A1 (0.38) ALDH1A1TSHRSMN1; SMN2ATMHPGD
SCHEMBL7968534 0.85 ALDH1A1 (0.58) ALDH1A1TSHRSMN1; SMN2ATMHPGD
SCHEMBL9562005 0.85 ALDH1A1 (0.61) ALDH1A1TSHRTP53CYP3A4
SCHEMBL6939710 0.85 ALDH1A1 (0.76) ALDH1A1TSHRSMN1; SMN2ATMHPGD
SCHEMBL17923568 0.84 ALDH1A1 (0.62) ALDH1A1TSHRTP53CYP3A4
Acrylonitrile SCHEMBL94006 0.83 ALDH1A1 (0.56) ALDH1A1TSHRSMN1; SMN2ATMHPGD
Ethylene SCHEMBL20476752 0.83 ALDH1A1 (0.73) ALDH1A1TSHRSMN1; SMN2ATMHPGD
SCHEMBL13275897 0.83 TSHR (0.50) ALDH1A1TSHRATMHPGDTHRB
SCHEMBL2259513 0.82 ATM (0.50) ALDH1A1TSHRATMHPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10923707-B2 Dry process method for producing electrodes for electrochemical devices and electrodes for electrochemical devices FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-02-16 US claimed
US-20180175366-A1 DRY PROCESS METHOD FOR PRODUCING ELECTRODES FOR ELECTROCHEMICAL DEVICES AND ELECTRODES FOR ELECTROCHEMICAL DEVICES FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2018-06-21 US claimed
CN-113169335-B Electrode composition for cathode of battery cell of lithium ion battery, cathode slurry composition containing same, cathode and battery 阿朗新科德国有限责任公司 2023-10-13 CN disclosed
EP-3900086-B1 ELECTRODE COMPOSITION FOR A CATHODE OF A CELL OF A LITHIUM-ION BATTERY, A CATHODE SLURRY COMPOSITION, A CATHODE AND THE BATTERY INCORPORATING IT ARLANXEO DEUTSCHLAND GMBH (DE) 2023-01-11 EP disclosed
EP-3900086-A1 ELECTRODE COMPOSITION FOR A CATHODE OF A CELL OF A LITHIUM-ION BATTERY, A CATHODE SLURRY COMPOSITION, A CATHODE AND THE BATTERY INCORPORATING IT ARLANXEO Deutschland GmbH (DE) 2021-10-27 EP disclosed
CN-113169335-A Electrode composition for cathode of battery cell of lithium ion battery, cathode slurry composition comprising same, cathode and battery 阿朗新科德国有限责任公司 2021-07-23 CN disclosed
US-10923707-B2 Dry process method for producing electrodes for electrochemical devices and electrodes for electrochemical devices FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2021-02-16 US disclosed
WO-2020126343-A1 ELECTRODE COMPOSITION FOR A CATHODE OF A CELL OF A LITHIUM-ION BATTERY, A CATHODE SLURRY COMPOSITION, A CATHODE AND THE BATTERY INCORPORATING IT ARLANXEO DEUTSCHLAND GMBH (DE) 2020-06-25 WO disclosed
US-20180175366-A1 DRY PROCESS METHOD FOR PRODUCING ELECTRODES FOR ELECTROCHEMICAL DEVICES AND ELECTRODES FOR ELECTROCHEMICAL DEVICES FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2018-06-21 US disclosed
US-8938878-B2 Method for manufacturing electronic parts device and resin composition for electronic parts encapsulation NITTO DENKO CORPORATION (JP) 2015-01-27 US disclosed
US-20140242295-A1 METHOD FOR PRODUCING SLURRY FOR HEAT-RESISTANT LAYER FOR LITHIUM ION SECONDARY BATTERY AND METHOD FOR PRODUCING ELECTRODE FOR LITHIUM ION SECONDARY BATTERY ZEON CORPORATION (JP) 2014-08-28 US disclosed
US-20140242296-A1 METHOD FOR PRODUCING SLURRY FOR HEAT-RESISTANT LAYER FOR LITHIUM ION SECONDARY BATTERY AND METHOD FOR PRODUCING ELECTRODE FOR LITHIUM ION SECONDARY BATTERY ZEON CORPORATION (JP) 2014-08-28 US disclosed
US-20140083760-A1 METHOD FOR PRODUCTION OF SEALED BODY, FRAME-SHAPED SPACER FOR PRODUCTION OF SEALED BODY, SEALED BODY AND ELECTRONIC INSTRUMENT NITTO DENKO CORPORATION (JP) 2014-03-27 US disclosed
US-20120055015-A1 METHOD FOR MANUFACTURING ELECTRONIC PARTS DEVICE AND RESIN COMPOSITION FOR ELECTRONIC PARTS ENCAPSULATION NITTO DENKO CORPORATION (JP) 2012-03-08 US disclosed
EP-2426707-A1 Method for Manufacturing Electronic Parts Device and Resin Composition for Electronic Parts Encapsulation NITTO DENKO CORPORATION (JP) 2012-03-07 EP disclosed