Perchlorate

Perchlorate

SCHEMBL3136730

CSc1ccc([S+](c2ccccc2)c2ccccc2)cc1.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP1A2 P05177 2/20 0.38
MEN1 O00255 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 4/20 0.37
LMNA P02545 1/20 0.36
NOS3 P29474 2/20 0.34
NOS1 P29475 2/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
AKR1C1 Q04828 1/20 0.34
KDM1A O60341 1/20 0.34
EGFR P00533 1/20 0.33
PDGFRB P09619 1/20 0.33
KDR P35968 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 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
SCHEMBL12256916 0.92 KMT2A (0.42) PTGS2KMT2ACYP1A2MEN1CYP3A4
Bromide SCHEMBL3136632 0.90 KMT2A (0.41) PTGS2KMT2ACYP1A2MEN1CYP3A4
SCHEMBL3132890 0.84 PTGS2 (0.42) PTGS2KMT2ACYP1A2MEN1CYP3A4
SCHEMBL5442157 0.81 KMT2A (0.40) PTGS2KMT2ACYP1A2MEN1CYP3A4
SCHEMBL3144436 0.81 PTGS2 (0.40) PTGS2KMT2ACYP1A2MEN1CYP3A4
Perchlorate SCHEMBL108183 0.80 CYP3A4 (0.33) PTGS2CYP3A4ALDH1A1KDM4ENPC1
SCHEMBL3282071 0.79 KMT2A (0.40) PTGS2KMT2ACYP1A2MEN1CYP3A4
Trifluoromethanesulfonic Acid SCHEMBL3139918 0.78 ALDH1A1 (0.40) PTGS2KMT2AMEN1ALDH1A1LMNA
SCHEMBL670781 0.77 KMT2A (0.41) PTGS2KMT2ACYP1A2MEN1CYP3A4
Perchlorate SCHEMBL3135936 0.77 ACHE (0.43) KMT2ACYP1A2MEN1CYP3A4CYP2C9

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 PTGS2 1519/4885KMT2A 833/4885CYP1A2 378/4885

“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.