Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4748972

O=C(O)C(F)(F)F.OC1CCN(c2ccccc2)C1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 5/20 0.55
DPP4 P27487 3/20 0.55
DPP8 Q6V1X1 3/20 0.55
DPP9 Q86TI2 3/20 0.55
DPP7 Q9UHL4 3/20 0.55
MAPK1 P28482 2/20 0.44
MYC P01106 2/20 0.43
WDR5 P61964 2/20 0.43
RORC P51449 3/20 0.42
DGAT1 O75907 1/20 0.42
GPR119 Q8TDV5 1/20 0.42

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
SCHEMBL6398487 0.87 NOTUM (0.59) NOTUMDPP4RORC
SCHEMBL3436548 0.87 NOTUM (0.59) NOTUMDPP4RORC
SCHEMBL17392707 0.87 NOTUM (0.59) NOTUMDPP4RORC
Trifluoroacetic Acid SCHEMBL15212493 0.83 DPP4 (0.60) NOTUMDPP4DPP8DPP9DPP7
Trifluoroacetic Acid SCHEMBL18214922 0.83 DPP4 (0.60) NOTUMDPP4DPP8DPP9DPP7
SCHEMBL16292723 0.81 NOTUM (0.54) NOTUMDPP4DPP8DPP9DPP7
Trifluoroacetic Acid SCHEMBL4749328 0.80 DPP4 (0.60) DPP4DPP8DPP9DPP7GPR119
Trifluoroacetic Acid SCHEMBL19642281 0.78 DPP4 (0.55) NOTUMDPP4DPP8DPP9DPP7
Pivalate SCHEMBL27800311 0.78 GPR119 (0.54) NOTUMMAPK1RORCGPR119
SCHEMBL6628944 0.76 ALDH1A1 (0.53) NOTUMRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008121065-A1 NOVEL PYRROLIDINE DERIVATIVES AS ANTAGONISTS OF THE CHEMOKINE RECEPTOR ASTRAZENECA AB (SE) 2008-10-09 WO disclosed