SCHEMBL4939567

SCHEMBL4939567

CCCCCC(CC)OC(C)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 2/20 0.42
OPRM1 P35372 1/20 0.39
SMPD1 P17405 3/20 0.38
MAPT P10636 2/20 0.38
TRPA1 O75762 1/20 0.38
DDAH1 O94760 1/20 0.38
GAPDH P04406 1/20 0.38
GPR84 Q9NQS5 5/20 0.38
CA1 P00915 2/20 0.38
FFAR1 O14842 1/20 0.38
LMNA P02545 2/20 0.37
TP53 P04637 2/20 0.36
CYP2D6 P10635 2/20 0.35
GMNN O75496 1/20 0.35
POLB P06746 1/20 0.35
THPO P40225 1/20 0.35
MTOR P42345 1/20 0.35
BLM P54132 1/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.35

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
SCHEMBL4164545 0.98 SPHK1 (0.45) SPHK1OPRM1SMPD1MAPTGPR84
SCHEMBL28752174 0.85 SPHK1 (0.45) SPHK1OPRM1SMPD1MAPTGPR84
SCHEMBL19215716 0.84 TSHR (0.38) LMNA
SCHEMBL4942699 0.84 TSHR (0.38) LMNA
SCHEMBL28024653 0.84 OPRM1 (0.44) SPHK1OPRM1SMPD1CA1LMNA
SCHEMBL134089 0.84 OPRM1 (0.42) SPHK1OPRM1SMPD1GPR84FFAR1
Propylene Glycol SCHEMBL18227008 0.83 LMNA (0.43) SPHK1OPRM1MAPTGPR84CA1
SCHEMBL1506140 0.83 SPHK1 (0.39) SPHK1OPRM1GPR84CA1FFAR1
SCHEMBL4454449 0.83 TSHR (0.50) SPHK1OPRM1SMPD1MAPTGPR84
SCHEMBL25953784 0.82 OPRM1 (0.42) SPHK1OPRM1SMPD1GPR84LMNA

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104995163-B The low viscosity concentrate solution of alkaline-earth alkoxides in aprotic solvent and preparation method thereof 罗克伍德锂有限责任公司 2018-04-17 CN disclosed
US-9809657-B2 Low-viscosity concentrated solutions of alkaline earth metal alkoxides in aprotic solvents and processes for preparation thereof ALBEMARLE GERMANY GMBH (DE) 2017-11-07 US disclosed
CN-102164934-B Method for producing mono-hydroxy-functionalized dialkylphosphinic acids, esters and salts by means of ethylene oxide, and use thereof CLARIANT FINANCE (BVI) LTD. (VG) 2015-11-25 CN disclosed
US-20150291708-A1 LOW-VISCOSITY CONCENTRATED SOLUTIONS OF ALKALINE EARTH METAL ALKOXIDES IN APROTIC SOLVENTS AND PROCESSES FOR PREPARATION THEREOF Rockwood Lithium GmbH (DE) 2015-10-15 US disclosed
CN-102186866-B Method for producing mono amino-functionalised dialkylphosphinite acids esters and salts and use thereof CLARIANT INT LTD 2015-04-29 CN disclosed
CN-102171228-B Method for producing mono-hydroxy-functionalized dialkylphosphinic acids, esters and salts by means of vinyl esters of carboxylic acids and use thereof CLARIANT FINANCE BVI LTD 2015-03-25 CN disclosed
CN-102171226-B Process for preparing mono-allyl-functionalized dialkylphosphinic acids, salts and esters thereof with allylic compounds, and the use thereof CLARIANT FINANCE BVI LTD 2015-02-11 CN disclosed
CN-102164933-B Process for preparing mono-carboxy-functionalized dialkylphosphinic acids, esters and salts by means of alkylene oxides and use thereof CLARIANT INT LTD 2014-12-10 CN disclosed
CN-102186868-B Method for producing mono-hydroxyfunctionalized dialkylphosphinic acids and esters and salts thereof by means of allyl alcohols and use thereof CLARIANT INT LTD 2014-12-10 CN disclosed
CN-102186863-B Method for producing mono-hydroxyfunctionalized dialkylphosphinic acids and esters and salts thereof by means of acroleins and use thereof CLARIANT INT LTD 2014-07-23 CN disclosed
CN-102186867-A Method for producing mono-aminofunctionalized dialkylphosphinic acids and esters and salts thereof by means of acrylnitriles and use thereof CLARIANT INT LTD 2011-09-14 CN disclosed
CN-102186866-A Method for producing mono amino-functionalised dialkylphosphinite acids esters and salts and use thereof CLARIANT INT LTD 2011-09-14 CN disclosed
CN-102177169-A Process for preparing monovinyl-functionalized dialkylphosphinic acids, salts and esters thereof and use thereof CLARIANT FINANCE BVI LTD 2011-09-07 CN disclosed
CN-102177165-A Method for producing mono-aminofunctionalized dialkylphosphinic acids and esters and salts thereof and use thereof CLARIANT FINANCE BVI LTD 2011-09-07 CN disclosed
CN-102177167-A Method for producing mono-hydroxyfunctionalized dialkylphosphinic acids and esters and salts thereof and use thereof CLARIANT FINANCE BVI LTD 2011-09-07 CN disclosed
CN-102171226-A Process for preparing mono-allyl-functionalized dialkylphosphinic acids, salts and esters thereof with allylic compounds, and the use thereof CLARIANT INT LTD 2011-08-31 CN disclosed
CN-102171228-A Method for producing mono-hydroxy-functionalized dialkylphosphinic acids, esters and salts by means of vinyl esters of carboxylic acids and use thereof CLARIANT INT LTD 2011-08-31 CN disclosed
CN-102164933-A Process for preparing mono-carboxy-functionalized dialkylphosphinic acids, esters and salts by means of alkylene oxides and use thereof CLARIANT INT LTD 2011-08-24 CN disclosed
CN-102164934-A Method for producing mono-hydroxy-functionalized dialkylphosphinic acids, esters and salts by means of ethylene oxide, and use thereof CLARIANT INT LTD 2011-08-24 CN disclosed
US-20080280106-A1 Method of Reusing Flexible Mold and Microstructure Precursor Composition 3M INNOVATIVE PROPERTIES COMPANY 2008-11-13 US disclosed