Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL2230280

CCCC[n+]1ccn(C)c1.CC[n+]1ccn(C)c1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.38

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.38
KCNH2 Q12809 7/20 0.36
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RXFP1 Q9HBX9 2/20 0.32
BLM P54132 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PABPC1 P11940 1/20 0.32
HPGD P15428 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 SCHEMBL19927669 0.96 ACHE (0.36) ACHEKCNH2KDM4EALDH1A1MAPT
Trifluoromethanesulfonic Acid SCHEMBL192398 0.96 ACHE (0.40) ACHEKCNH2KDM4EALDH1A1MAPT
Trifluoromethanesulfonic Acid SCHEMBL28555818 0.94 ACHE (0.40) ACHEKCNH2KDM4EALDH1A1MAPT
Trifluoromethanesulfonic Acid SCHEMBL3615949 0.92 KCNH2 (0.41) ACHEKCNH2ALDH1A1MAPTHTT
Trifluoromethanesulfonic Acid SCHEMBL514444 0.90 KCNH2 (0.43) ACHEKCNH2
Trifluoromethanesulfonic Acid SCHEMBL318763 0.90 KCNH2 (0.43) ACHEKCNH2
Trifluoromethanesulfonic Acid SCHEMBL318766 0.90 KCNH2 (0.43) ACHEKCNH2
Trifluoromethanesulfonic Acid SCHEMBL22265262 0.90 KCNH2 (0.43) ACHEKCNH2
Trifluoromethanesulfonic Acid SCHEMBL318174 0.90 KCNH2 (0.43) ACHEKCNH2
Trifluoromethanesulfonic Acid SCHEMBL318565 0.90 KCNH2 (0.43) ACHEKCNH2

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-2528988-A1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND LIGHT-EMITTING COMPONENT Osram AG (DE) 2012-12-05 EP disclosed
WO-2011088916-A1 PHOSPHORESCENT METAL COMPLEX COMPOUND, METHOD FOR THE PRODUCTION THEREOF AND LIGHT-EMITTING COMPONENT SIEMENS AKTIENGESELLSCHAFT (DE) 2011-07-28 WO disclosed