SCHEMBL3137494

SCHEMBL3137494

CC(C)(C)Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1.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 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 6/20 0.34
KIF11 P52732 2/20 0.31
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
DHFR P00374 2/20 0.31
BACE1 P56817 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL3134963 0.86 RAB9A (0.40) DHFRALDH1A1
SCHEMBL3136188 0.86 RAB9A (0.40) DHFRALDH1A1
SCHEMBL3244276 0.84 TSHR (0.41) TACR1KIF11IDO1TDO2ALDH1A1
SCHEMBL3130125 0.83 KIF11 (0.37) TACR1KIF11IDO1TDO2BACE1
SCHEMBL3136104 0.83 KIF11 (0.37) TACR1KIF11IDO1TDO2BACE1
SCHEMBL3144568 0.83 KIF11 (0.46) TACR1KIF11IDO1TDO2BACE1
SCHEMBL3139294 0.83 KIF11 (0.46) TACR1KIF11IDO1TDO2BACE1
SCHEMBL3139630 0.83 KIF11 (0.34) KIF11
SCHEMBL3139818 0.82 NFE2L2 (0.39) TACR1KIF11IDO1TDO2DHFR
SCHEMBL3132670 0.82 NFE2L2 (0.39) TACR1KIF11IDO1TDO2DHFR

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 TACR1 621/4885KIF11 4608/4885IDO1 336/4885

“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.