Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL16700754

CC[n+]1ccc(C)cc1.O=C([O-])C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
CHKA P35790 1/20 0.34
CA2 P00918 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CCR5 P51681 2/20 0.33
CES2 O00748 1/20 0.33
ACHE P22303 1/20 0.33
CES1 P23141 1/20 0.33
LMNA P02545 1/20 0.32
TERT O14746 1/20 0.32
MAPT P10636 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
Trifluoroacetic Acid SCHEMBL16700556 0.88 HTT (0.46) HTTCYP1A2CYP2D6CYP2C19CHKA
Acetic Acid SCHEMBL29252868 0.85 HTT (0.44) HTTCHKACES2CES1LMNA
Trifluoroacetic Acid SCHEMBL16700217 0.80 PABPC1 (0.47) HTTLMNA
Trifluoroacetic Acid SCHEMBL6115378 0.79 KMT2A (0.41) HTTNPSR1ACHELMNAMAPT
Trifluoromethanesulfonic Acid SCHEMBL3629231 0.79 KCNH2 (0.41) HTTACHEMAPT
SCHEMBL62492 0.78
Bromide SCHEMBL1502745 0.76 HTT (0.54) HTTCYP1A2CYP2D6CYP2C19CHKA
Iodide SCHEMBL1502806 0.76 HTT (0.54) HTTCYP1A2CYP2D6CYP2C19CHKA
Hydrochloric Acid SCHEMBL1502838 0.76 HTT (0.54) HTTCYP1A2CYP2D6CYP2C19CHKA
Fluoride Ion SCHEMBL1502900 0.76 HTT (0.54) HTTCYP1A2CYP2D6CYP2C19CHKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3244987-B1 SEPARATIONS WITH IONIC LIQUID SOLVENTS CHEVRON PHILLIPS CHEMICAL CO LP (US) 2022-06-22 EP claimed
EP-3244987-A1 SEPARATIONS WITH IONIC LIQUID SOLVENTS Chevron Phillips Chemical Company LP (US) 2017-11-22 EP claimed
US-20150133711-A1 Separations With Ionic Liquid Solvents CHEVRON PHILLIPS CHEMICAL COMPANY LP 2015-05-14 US claimed
EP-3244987-B1 SEPARATIONS WITH IONIC LIQUID SOLVENTS CHEVRON PHILLIPS CHEMICAL CO LP (US) 2022-06-22 EP disclosed
US-10227274-B2 Separations with ionic liquid solvents CHEVRON PHILLIPS CHEMICAL COMPANY LP (US) 2019-03-12 US disclosed
EP-3244987-A1 SEPARATIONS WITH IONIC LIQUID SOLVENTS Chevron Phillips Chemical Company LP (US) 2017-11-22 EP disclosed
US-20150133711-A1 Separations With Ionic Liquid Solvents CHEVRON PHILLIPS CHEMICAL COMPANY LP 2015-05-14 US disclosed