Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL5445998

CCO[Si](CCC[n+]1ccn(-c2c(C)cc(C)cc2C)c1)(OCC)OCC.O=S(=O)([O-])C(F)(F)F

nearest known ligand 0.34

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Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ RXFP1 Q9HBX9 2/20 0.30
▸ BLM P54132 1/20 0.30
▸ NPSR1 Q6W5P4 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
Trifluoromethanesulfonic Acid SCHEMBL5448175 0.90 ACHE (0.40) ACHEKDM4EALDH1A1MEN1CYP3A4
Bromide SCHEMBL5446114 0.88 KDM4E (0.31) KDM4EALDH1A1MEN1CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL5445993 0.88 KDM4E (0.31) KDM4EALDH1A1MEN1CYP3A4CYP2C9
SCHEMBL5444525 0.87 — —
Trifluoromethanesulfonic Acid SCHEMBL5446074 0.79 KDM4E (0.35) KDM4ERXFP1NPSR1
SCHEMBL18103972 0.77 L3MBTL1 (0.44) KDM4EALDH1A1MEN1CYP3A4CYP2C9
Trifluoromethanesulfonic Acid SCHEMBL5455690 0.77 — —
Hydrochloric Acid SCHEMBL5450114 0.76 KDM4E (0.30) KDM4EALDH1A1
Bromide SCHEMBL5443574 0.76 KDM4E (0.30) KDM4EALDH1A1
SCHEMBL5449865 0.76 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021615-A1 Imidazolium salts that can be immobilized MERCK PATENT GMBH (DE) 2007-01-25 — — US claimed
US-20070021615-A1 Imidazolium salts that can be immobilized MERCK PATENT GMBH (DE) 2007-01-25 — — US disclosed
EP-1658297-A1 IMIDAZOLIUM SALTS THAT CAN BE IMMOBILIZED MERCK PATENT GmbH (DE) 2006-05-24 — — EP disclosed
WO-2005016940-A1 IMIDAZOLIUM SALTS THAT CAN BE IMMOBILIZED MERCK PATENT GMBH (DE) 2005-02-24 — — WO 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-20070021615-A1 Imidazolium salts that can be immobilized IDH1, IDH3B, MIF ACHE 3129/4885KDM4E 1831/4885ALDH1A1 1833/4885

“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.

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