Acetaldehyde

Acetaldehyde

SCHEMBL1813490

CC(=O)OC(C)=O.CC=O

nearest known ligand 0.71

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.71
TSHR P16473 4/20 0.71
HSD17B10 Q99714 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
LMNA P02545 3/20 0.33
THPO P40225 1/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 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
Formic Acid SCHEMBL3877041 0.86 ALDH1A1 (0.71) ALDH1A1TSHRHSD17B10TDP1KEAP1
SCHEMBL1330344 0.84
SCHEMBL523 0.84
SCHEMBL1331977 0.84
SCHEMBL9866292 0.84
SCHEMBL5305593 0.84 ALDH1A1 (1.00) ALDH1A1TSHRHSD17B10TDP1KEAP1
SCHEMBL1331774 0.84
SCHEMBL9586649 0.81 ALDH1A1 (0.91) ALDH1A1TSHRHSD17B10TDP1KEAP1
SCHEMBL10341165 0.81
SCHEMBL15391984 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105152928-A Synthesis method for ethylidene diacetate SHANDONG LECRON ENERGY SAVING NEW MATERIAL CO LTD 2015-12-16 CN disclosed
US-8931569-B2 Method and apparatus for a wellbore assembly WEATHERFORD/LAMB, INC. (US) 2015-01-13 US disclosed
US-20110108285-A1 METHOD AND APPARATUS FOR A WELLBORE ASSEMBLY WELLS FARGO BANK, NATIONAL ASSOCIATION 2011-05-12 US disclosed
CN-1117062-C Method for producing vinyl carboxylates EASTMAN CHEM CO (US) 2003-08-06 CN disclosed
EP-0971874-B1 PROCESS FOR GENERATING VINYL CARBOXYLATE ESTERS EASTMAN CHEM CO (US) 2002-01-30 EP disclosed
US-6267864-B1 USING CATALYST; APPLYING ELECTROMAGNETIC WAVES NANOMATERIALS RESEARCH CORPORATION 2001-07-31 US disclosed
CN-1251084-A Method for producing vinyl carboxylates EASTMAN CHEM CO (US) 2000-04-19 CN disclosed
EP-0971874-A1 PROCESS FOR GENERATING VINYL CARBOXYLATE ESTERS EASTMAN CHEMICAL COMPANY (US) 2000-01-19 EP disclosed
US-5821384-A REACTING A CARBONYL COMPOUND SELECTED FROM ALIPHATIC ALDEHYDES AND KETONES AND AN ANHYDRIDE OF AN ALIPHATIC CARBOXYLIC ACID IN A DISTILLATION ZONE; RECOVERING; SEPARATION EASTMAN CHEMICAL COMPANY (US) 1998-10-13 US disclosed
WO-1998043938-A1 PROCESS FOR GENERATING VINYL CARBOXYLATE ESTERS EASTMAN CHEMICAL COMPANY (US) 1998-10-08 WO disclosed