SCHEMBL3134381

SCHEMBL3134381

Clc1ccc([S+](c2ccccc2)c2ccccc2)cc1.O=S(=O)([O-])c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.41
KDM1A O60341 2/20 0.41
CCR1 P32246 1/20 0.41
CCR2 P41597 1/20 0.41
FLT1 P17948 3/20 0.40
FLT4 P35916 3/20 0.40
KDR P35968 3/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
ENPP3 O14638 1/20 0.38
ENPP1 P22413 1/20 0.38
ENPP2 Q13822 1/20 0.38
KIF11 P52732 2/20 0.38
HSD11B1 P28845 1/20 0.38
CYP3A4 P08684 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
L3MBTL1 Q9Y468 2/20 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
SCHEMBL3139840 1.00 CNR2 (0.41) CNR2KDM1ACCR1CCR2FLT1
SCHEMBL3139768 0.92 ALDH1A1 (0.43) MAPTKIF11HSD11B1ALDH1A1TSHR
SCHEMBL3132680 0.92 ALDH1A1 (0.43) MAPTKIF11HSD11B1ALDH1A1TSHR
SCHEMBL503701 0.91 ALDH1A1 (0.45) MAPTKIF11HSD11B1ALDH1A1TSHR
SCHEMBL3130383 0.87 RORC (0.39) KIF11HSD11B1ALDH1A1TSHR
SCHEMBL3140028 0.87 RORC (0.39) KIF11HSD11B1ALDH1A1TSHR
SCHEMBL1088684 0.86 ALDH1A1 (0.46) FLT1FLT4KDRHSD11B1CYP3A4
SCHEMBL3134860 0.85 HSD11B1 (0.42) KIF11HSD11B1ALDH1A1TSHR
SCHEMBL3136043 0.85 ALDH1A1 (0.46) TP53MAPTKIF11HSD11B1CYP3A4
SCHEMBL3136569 0.85 ALDH1A1 (0.46) TP53MAPTKIF11HSD11B1CYP3A4

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-1676835-B1 PROCESS FOR PRODUCING TRIARYLSULFONIUM SALT WAKO PURE CHEM IND LTD (JP) 2014-12-10 EP disclosed
US-7642368-B2 for use as acid generator in semiconductor manufacture; triarylsulfonium salt having a structure that only one aromatic ring of three is different, in a high yield and by-product inhibition; reacting a diaryl sulfoxide with an aryl Grignard reagent in presence of chlorotrialkylsilane and strong acid WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2010-01-05 US disclosed
US-20070083060-A1 for use as acid generator in semiconductor manufacture; triarylsulfonium salt having a structure that only one aromatic ring of three is different, in a high yield and by-product inhibition; reacting a diaryl sulfoxide with an aryl Grignard reagent in presence of chlorotrialkylsilane and strong acid FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2007-04-12 US disclosed
EP-1676835-A1 PROCESS FOR PRODUCING TRIARYLSULFONIUM SALT Wako Pure Chemical Industries, Ltd. (JP) 2006-07-05 EP 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 (1 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-20070083060-A1 for use as acid generator in semiconductor manufacture; triarylsulfonium salt having a structure that only one aromatic ring of three is different, in a high yield and by-product inhibition; reacting a diaryl sulfoxide with an aryl Grignard reagent in presence of chlorotrialkylsilane and strong acid ARSA, HAO2, HAO1 CNR2 1002/4885KDM1A 449/4885CCR1 1514/4885

“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.