SCHEMBL6553219

SCHEMBL6553219

C=CC(C)c1ccccc1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.39
ELANE P08246 1/20 0.38
MMP2 P08253 3/20 0.36
MMP9 P14780 3/20 0.36
MMP8 P22894 3/20 0.36
MMP12 P39900 3/20 0.36
MMP13 P45452 3/20 0.36
MMP14 P50281 3/20 0.36
MMP16 P51512 3/20 0.36
MMP1 P03956 2/20 0.36
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
KCNH2 Q12809 2/20 0.35
CYP1A2 P05177 1/20 0.35
TTR P02766 2/20 0.33
HSD11B1 P28845 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP3 P08254 2/20 0.33
PGAM1 P18669 1/20 0.33

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
SCHEMBL28129185 0.98 MYC (0.38) MYCELANEMMP2MMP9MMP8
SCHEMBL28129177 0.98 MYC (0.38) MYCELANEMMP2MMP9MMP8
SCHEMBL28129711 0.98 MYC (0.38) MYCELANEMMP2MMP9MMP8
SCHEMBL28840289 0.98 MYC (0.38) MYCELANEMMP2MMP9MMP8
SCHEMBL27695802 0.86 CYP1A2 (0.39) MYCELANEMMP2MMP9MMP8
SCHEMBL7559113 0.80 GABRA1 (0.44) ELANEHTR2CCYP1A2TSHRSMN1; SMN2
SCHEMBL29617 0.79 HSD11B1 (0.47) MYCMMP2MMP9MMP8MMP12
SCHEMBL29353004 0.79 HSD11B1 (0.47) MYCMMP2MMP9MMP8MMP12
SCHEMBL9098597 0.79 MYC (0.44) MYCMMP2MMP9MMP8MMP12
SCHEMBL27852913 0.79 HSD11B1 (0.47) MYCMMP2MMP9MMP8MMP12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459653-A Hydrophilic single-layer film 三井化学株式会社 2017-02-22 CN disclosed
EP-0841415-B1 Fine inorganic particles containing fibres and method for forming the same JAPAN EXLAN CO LTD (JP) 2004-02-25 EP disclosed
US-5928785-A ACRYLIC POLYMER WITH POLAR GROUPS SELECTED FROM SULFONIC ACID GROUP, CARBOXYL CROUP AND PHOSPHORIC ACID GROUP JAPAN EXLAN COMPANY LIMITED (JP) 1999-07-27 US disclosed
WO-1999005986-A1 IMPROVED DENTAL FLOSS WHITEHILL ORAL TECHNOLOGIES, INC. (US) 1999-02-11 WO disclosed
US-5472818-A Comprising vinyl monomer, ring-opening polymerizable monomer and polyester; microspheres; toners for electrography TOYO BOSEKI KABUSHIKI KAISHA (JP) 1995-12-05 US disclosed
US-5422227-A Condensation polymers containing ionic groups; toners for electrography TOYO BOSEKI KABUSHIKI KAISHA (JP) 1995-06-06 US disclosed
US-5382624-A Addition polymerization within polyester particle in dispersion, toners, electrography TOYO BOSEKI KABUSHIKI KAISHA (JP) 1995-01-17 US disclosed
US-5352521-A An ionic addition-condensation copolymers has narrow molecular weight distribution TOYO BOSEKI KABUSHIKI KAISHA (JP) 1994-10-04 US disclosed
US-5344673-A Particle size, polyesters TOYO BOSEKI KABUSHIKI KAISHA (JP) 1994-09-06 US disclosed