SCHEMBL1576901

SCHEMBL1576901

CC(=O)c1ccc([S+]([O-])c2ccc(C(C)=O)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.48
MAPT P10636 6/20 0.48
RAB9A P51151 5/20 0.48
HPGD P15428 4/20 0.48
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.46
HSD17B1 P14061 1/20 0.46
NOS3 P29474 2/20 0.43
NOS1 P29475 2/20 0.43
NPC1 O15118 4/20 0.42
ALDH1A1 P00352 2/20 0.42
STAT3 P40763 1/20 0.42
STAT1 P42224 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GAA P10253 1/20 0.41
XDH P47989 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
STS P08842 1/20 0.39

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
SCHEMBL4102019 0.92 HSD17B1 (0.61) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL6956930 0.92 MAPT (0.55) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL7929382 0.90 MAOB (0.47) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL5320294 0.90 KMT2A (0.53) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL9367770 0.87 ALDH1A1 (0.53) MAPK1MAPTRAB9ALMNAKMT2A
SCHEMBL31256698 0.84 MAPK1 (0.47) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL9228034 0.82 MAPT (0.42) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL3198744 0.82 MAPT (0.54) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL22539176 0.82 MAPK1 (0.45) MAPK1MAPTRAB9AHPGDLMNA
SCHEMBL50646 0.79 MAPT (0.68) MAPK1MAPTRAB9AHPGDLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2186799-B1 AROMATIC SULFONIUM SALT COMPOUND ADEKA CORP (JP) 2015-07-08 EP disclosed
CN-101778818-B Aromatic sulfonium salt compound ADEKA CORP 2014-01-08 CN disclosed
EP-2308865-B1 Novel aromatic sulfonium salt compound, photo-acid generator comprising the same and photopolymerizable composition containing the same, resin composition for optical three-dimensional shaping, and method of optically forming three-dimensional shape ADEKA CORP (JP) 2013-08-07 EP disclosed
EP-1557413-B1 NOVEL AROMATIC SULFONIUM SALT COMPOUND, PHOTO-ACID GENERATOR COMPRISING THE SAME AND PHOTOPOLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN COMPOSITION FOR OPTICAL THREE-DIMENSIONAL SHAPING, AND METHOD OF OPTICALLY FORMING THREE-DIMENSIONAL SHAPE ADEKA CORP (JP) 2012-08-01 EP disclosed
US-8227624-B2 Aromatic sulfonium salt compound ADEKA CORPORATION (JP) 2012-07-24 US disclosed
US-20110152540-A1 AROMATIC SULFONIUM SALT COMPOUND ADEKA CORPORATION (JP) 2011-06-23 US disclosed
EP-2308865-A1 Novel aromatic sulfonium salt compound, photo-acid generator comprising the same and photopolymerizable composition containing the same, resin composition for optical three-dimensional shaping, and method of optically forming three-dimensional shape Adeka Corporation (JP) 2011-04-13 EP disclosed
CN-101778818-A Aromatic sulfonium salt compound ADEKA COR 2010-07-14 CN disclosed
EP-2186799-A1 AROMATIC SULFONIUM SALT COMPOUND Adeka Corporation (JP) 2010-05-19 EP disclosed
US-7611817-B2 Capable of providing stereolithographic resin compositions which do not suffer from hindrance to curing by oxygen, can easily give shaped articles having desired sizes by virtue of high accuracy thereof in curing, can attain satisfactory curing depth owing to high sensitivity thereof for radiant energy ADEKA CORPORATION (JP) 2009-11-03 US disclosed
US-20060055088-A1 Novel aromatic sulfonium salt compound, photo-acid generator comprising the same and photopolymerizable composition containing the same, resin composition for optical three-dimensional shaping and method of optically forming tree-dimensional shape ASAHI DENKA CO. LTD. (JP) 2006-03-16 US disclosed
EP-1557413-A1 NOVEL AROMATIC SULFONIUM SALT COMPOUND, PHOTO-ACID GENERATOR COMPRISING THE SAME AND PHOTOPOLYMERIZABLE COMPOSITION CONTAINING THE SAME, RESIN COMPOSITION FOR OPTICAL THREE-DIMENSIONAL SHAPING, AND METHOD OF OPTICALLY FORMING THREE-DIMENSIONAL SHAPE Asahi Denka Co., Ltd. (JP) 2005-07-27 EP disclosed
US-4036818-A Method of preparing polymers of polyphenylene type KORSHAK VASILY VLADIMIROVICH 1977-07-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060055088-A1 Novel aromatic sulfonium salt compound, photo-acid generator comprising the same and photopolymerizable composition containing the same, resin composition for optical three-dimensional shaping and method of optically forming tree-dimensional shape ARSA, NOX5, ATIC MAPK1 629/4885MAPT 1930/4885RAB9A 2360/4885
US-20110152540-A1 AROMATIC SULFONIUM SALT COMPOUND SLC43A1, SLC7A5, SPIN2B MAPK1 2278/4885MAPT 2042/4885RAB9A 1716/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.