Ethasulfuric Acid

Ethasulfuric Acid

SCHEMBL4595626

CCCCC(CC)COS(=O)(=O)[O-].[H+]

nearest known ligand 0.50

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TSHR P16473 5/20 0.46
TDP1 Q9NUW8 2/20 0.46
ATM Q13315 1/20 0.46
RECQL P46063 3/20 0.45
MAPK1 P28482 2/20 0.44
GLA P06280 1/20 0.44
HPGD P15428 1/20 0.44
EPHX2 P34913 1/20 0.44
BLM P54132 1/20 0.44
ALDH1A1 P00352 7/20 0.44
CA2 P00918 4/20 0.42
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
LMNA P02545 2/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37

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
Ethasulfuric Acid SCHEMBL30312334 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL57666 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL2293348 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL17456529 0.96 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL27915134 0.95 CYP3A4 (0.49) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL1416426 0.89 DNM1 (0.47) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL23387498 0.87 RECQL (0.67) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL29695271 0.86 RECQL (0.65) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL27224578 0.85 CA2 (0.52) CYP3A4L3MBTL1TSHRTDP1ATM
Ethasulfuric Acid SCHEMBL4410887 0.85 DNM1 (0.43) CYP3A4L3MBTL1TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1247793-B1 Improved process for the manufacture of 2-ethylhexyl acrylate ARKEMA FRANCE (FR) 2008-01-09 EP claimed
US-5659072-A REACTING ACRYLIC ACID AND ALCOHOL USING POLYMERIZATION INHIBITOR AND ACID CATALYST, ENTRAINING WATER FORMED BY DISTILLATION, CONDENSING AND SEPARATING PHASES BY SOLVENT EXTRACTION USING ESTERIFYING ALCOHOL ELF ATOCHEM S.A. (FR) 1997-08-19 US disclosed
US-5606102-A SOLVENT-FREE; USING SULFURIC ACID CATALYST ELF ATOCHEM S.A. (FR) 1997-02-25 US disclosed
US-5510514-A REACTION OF ACRYLIC OR METHACRYLIC ACID WITH ALKANOL IN THE PRESENCE OF SULFURIC ACID CATALYST ELF ATOCHEM S.A. (FR) 1996-04-23 US disclosed