SCHEMBL3130046

SCHEMBL3130046

Cc1cc(C)c([S+](c2ccccc2)c2ccccc2)c(C)c1.FC(F)(F)c1cc([B-](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 3/20 0.38
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
TAS2R14 Q9NYV8 2/20 0.33
P2RX1 P51575 1/20 0.33
KIF11 P52732 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
GAA P10253 1/20 0.32
RXRA P19793 1/20 0.31
RXRB P28702 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
TACR1 P25103 3/20 0.31
FLT1 P17948 1/20 0.31
FLT4 P35916 1/20 0.31
KDR P35968 1/20 0.31
NFE2L2 Q16236 1/20 0.31

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
SCHEMBL3139818 0.84 NFE2L2 (0.39) MAPTTAS2R14P2RX1KIF11ALDH1A1
SCHEMBL3132670 0.84 NFE2L2 (0.39) MAPTTAS2R14P2RX1KIF11ALDH1A1
SCHEMBL3244276 0.83 TSHR (0.41) MAPTMAPK1P2RX1KIF11ALDH1A1
SCHEMBL3126244 0.82 CYP1A2 (0.33) CYP1A2ALDH1A1TSHR
SCHEMBL3132765 0.82 PTPN5 (0.35) RAPGEF4MAPK1KIF11ALDH1A1TSHR
SCHEMBL3140107 0.82 KIF11 (0.33) TAS2R14P2RX1KIF11ALDH1A1TSHR
SCHEMBL5405540 0.80 MAPT (0.40) RAPGEF4CYP1A2CYP3A4MAPTMAPK1
SCHEMBL3139294 0.79 KIF11 (0.46) MAPTP2RX1KIF11ALDH1A1TSHR
SCHEMBL3144568 0.79 KIF11 (0.46) MAPTP2RX1KIF11ALDH1A1TSHR
SCHEMBL3136259 0.78 CYP1A2 (0.35) RAPGEF4CYP1A2ALDH1A1TSHRMETAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 RAPGEF4 2624/4885CYP1A2 378/4885CYP3A4 1216/4885

“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.