Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL7756523

Cc1cccc(C)c1OC(=S)c1c2ccccc2[n+](C)c2ccccc12.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.39

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 12/20 0.39
ACHE P22303 6/20 0.37
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.32
ESR1 P03372 1/20 0.32
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
ESR2 Q92731 1/20 0.32

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
Trifluoromethanesulfonic Acid SCHEMBL7752466 0.88 ACHE (0.36) KCNH2ACHE
Trifluoromethanesulfonic Acid SCHEMBL6256435 0.87 KCNH2 (0.39) KCNH2ACHESMN1; SMN2MEN1ESR1
Trifluoromethanesulfonic Acid SCHEMBL7752445 0.85 ACHE (0.36) KCNH2ACHE
Trifluoromethanesulfonic Acid SCHEMBL7025215 0.82 ACHE (0.38) KCNH2ACHE
Trifluoromethanesulfonic Acid SCHEMBL7755730 0.82 KCNH2 (0.44) KCNH2ACHESMN1; SMN2MEN1GAA
Trifluoromethanesulfonic Acid SCHEMBL7756534 0.82 KCNH2 (0.41) KCNH2ACHEGAA
Trifluoromethanesulfonic Acid SCHEMBL9090449 0.81 ACHE (0.35) KCNH2ACHE
Trifluoromethanesulfonic Acid SCHEMBL38661855 0.81 KCNH2 (0.36) KCNH2ACHE
Trifluoromethanesulfonic Acid SCHEMBL38663807 0.80 ACHE (0.38) KCNH2ACHEMEN1ESR1GAA
Trifluoromethanesulfonic Acid SCHEMBL38664715 0.79 KCNH2 (0.34) KCNH2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0755457-B1 Novel Aryl-N-Alkylacridanthiocarboxylate derivatives useful for chemiluminescent detection LUMIGEN INC (US) 2001-02-21 EP disclosed
US-5523212-A OXIDATION WITH PEROXIDE AND PEROXIDASE TO EXCITED ACRIDONE DERIVATIVE; DETECTING PROTEINS, HAPTENS, ANTIBODIES, ENZYMES LUMIGEN, INC. (US) 1996-06-04 US disclosed