SCHEMBL3288796

SCHEMBL3288796

CC=CC(=O)NCCCS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.44
EPHX2 P34913 1/20 0.44
MAPT P10636 1/20 0.38
ZDHHC20 Q5W0Z9 3/20 0.38
ZDHHC2 Q9UIJ5 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.37
EGFR P00533 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
BRD4 O60885 2/20 0.35
KMT2A Q03164 1/20 0.35
HTR1A P08908 2/20 0.35
HTR2C P28335 2/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
HDAC1 Q13547 1/20 0.34
APP P05067 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL173752 0.86 CBLB (0.39) APEX1EPHX2MAPTZDHHC20ZDHHC2
Hydrochloric Acid SCHEMBL3644712 0.85 CBLB (0.39) APEX1EPHX2MAPTZDHHC20ZDHHC2
Water SCHEMBL721100 0.85 CBLB (0.39) APEX1EPHX2MAPTZDHHC20ZDHHC2
SCHEMBL22187118 0.84 APEX1 (0.51) APEX1MAPTZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL11697171 0.82 EPHX2 (0.49) EPHX2MAPTZDHHC20ZDHHC2ALDH1A1
SCHEMBL21610956 0.82 APEX1 (0.49) APEX1MAPTZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL27189642 0.79 APEX1 (0.48) APEX1MAPTZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL7532607 0.79 ZDHHC20 (0.60) APEX1MAPTZDHHC20ZDHHC2EGFR
SCHEMBL157106 0.79 APEX1 (0.48) APEX1MAPTZDHHC20ZDHHC2SMN1; SMN2
SCHEMBL7532604 0.79 ZDHHC20 (0.60) APEX1MAPTZDHHC20ZDHHC2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109641395-B Photocurable support material composition for inkjet 3D printer, ink, and method for producing support material and photo-molded object 株式会社日本触媒 2021-03-30 CN claimed
CN-108348402-A Polymerizable composition based on thermally cleavable compounds 义获嘉伟瓦登特公司 2018-07-31 CN disclosed
CN-103781456-B Based on the dental materialss with the monomer of unsticking characteristic on demand 义获嘉伟瓦登特公司 2017-03-29 CN disclosed
CN-103930085-B Dental material based on the compound with on-demand unsticking characteristic 义获嘉伟瓦登特公司 2016-09-07 CN disclosed
US-7704939-B2 Surfactant SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-04-27 US disclosed
US-20080200358-A1 Oiling Agent for Fiber Treatment SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2008-08-21 US disclosed
US-20070167343-A1 neutralized salt including alkylbenzenesulphonates (toluenesulfonic acid guanidine salt, toluenesulfonic acid DBU salt, toluenesulfonic acid DBN salt) for cleaning electonics SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-07-19 US disclosed
EP-0563342-B1 ELECTRORHEOLOGICAL FLUIDS CONTAINING ELECTRONICALLY CONDUCTIVE POLYMERS LUBRIZOL CORP (US) 1997-11-26 EP disclosed
EP-0562067-B1 ELECTRORHEOLOGICAL FLUIDS CONTAINING POLYANILINES LUBRIZOL CORP (US) 1997-04-09 EP disclosed
US-5595680-A Electrorheological fluids containing polyanilines THE LUBRIZOL CORPORATION (US) 1997-01-21 US disclosed
EP-0472687-A1 COMPOSITIONS AND POLYMER FABRICS TREATED WITH THE SAME. LUBRIZOL CORP (US) 1992-03-04 EP disclosed
EP-0472696-A1 COMPOSITIONS AND POLYMER FABRICS TREATED WITH THE SAME. LUBRIZOL CORP (US) 1992-03-04 EP disclosed
US-5079076-A Reaction product of hydrocarbyl substituted acid or anhydride with sulfo compound THE LUBRIZOL CORPORATION (US) 1992-01-07 US disclosed
US-5079081-A Reaction product of hydrocarbyl substituted carboxylic acid or anhydride and a sulfo compound THE LUBRIZOL CORPORATION (US) 1992-01-07 US disclosed
EP-0452472-A1 CURABLE AMINOPLAST COMPOSITIONS AND CATALYSTS FOR CURING SAME. LUBRIZOL CORP (US) 1991-10-23 EP disclosed
WO-1991014042-A1 COMPOSITIONS AND POLYMER FABRICS TREATED WITH THE SAME THE LUBRIZOL CORPORATION (US) 1991-09-19 WO disclosed
WO-1991014043-A1 COMPOSITIONS AND POLYMER FABRICS TREATED WITH THE SAME THE LUBRIZOL CORPORATION (US) 1991-09-19 WO disclosed
US-5037533-A Ore flotation process and use of phosphorus containing sulfo compounds THE LUBRIZOL CORPORATION (US) 1991-08-06 US disclosed
US-5025085-A Sulfinic or sulfonic acids and derivatives THE LUBRIZOL CORPORATION (US) 1991-06-18 US disclosed
WO-1991006597-A1 CURABLE AMINOPLAST COMPOSITIONS AND CATALYSTS FOR CURING SAME THE LUBRIZOL CORPORATION (US) 1991-05-16 WO disclosed