Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6077294

NCc1cc(Cl)ccc1-c1cnsn1.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F2 P00734 8/20 0.35
F10 P00742 7/20 0.35
PRSS1 P07477 7/20 0.35
PRSS2 P07478 7/20 0.35
PRSS3 P35030 7/20 0.35
F12 P00748 6/20 0.35
F7 P08709 6/20 0.35
F9 P00740 2/20 0.33
SHMT1 P34896 1/20 0.33
SHMT2 P34897 1/20 0.33
CYP2A6 P11509 1/20 0.33
HTR2C P28335 2/20 0.32
DPP4 P27487 2/20 0.32
DPP7 Q9UHL4 2/20 0.32
PDK2 Q15119 1/20 0.32
FFAR4 Q5NUL3 2/20 0.32
FFAR1 O14842 1/20 0.31
MME P08473 1/20 0.31
GRM2 Q14416 1/20 0.31

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
SCHEMBL6919231 0.87 CYP2A6 (0.41) CYP2A6DPP4
Trifluoroacetic Acid SCHEMBL28915050 0.68 ADRA1D (0.44) F2F10PRSS1PRSS2PRSS3
SCHEMBL6919603 0.67
Trifluoroacetic Acid SCHEMBL3582556 0.67 LOXL2 (0.42) F2F10PRSS1PRSS2PRSS3
SCHEMBL27567231 0.67 COPS5 (0.39) DPP4
Trifluoroacetic Acid SCHEMBL3571368 0.64 MEN1 (0.40) F2F10PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL7456464 0.64 F2 (0.39) F2F10PRSS1PRSS2PRSS3
SCHEMBL6077418 0.64 CYP2A6 (0.38) CYP2A6DPP4
SCHEMBL6079066 0.63 CYP2A6 (0.41) CYP2A6DPP4
Trifluoroacetic Acid SCHEMBL6435993 0.63 IDO1 (0.50)

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-7144899-B2 Thrombin inhibitors MERCK & CO., INC. (US) 2006-12-05 US disclosed
WO-2004032834-A2 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2004-04-22 WO disclosed
US-20040073025-A1 Thrombin inhibitors MERCK SHARP & DOHME CORP. 2004-04-15 US disclosed
WO-2002064559-A2 THROMBIN INHIBITORS MERCK & CO., INC. (US) 2002-08-22 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-20040073025-A1 Thrombin inhibitors F2, F11, F10 F2 1/4885F10 3/4885PRSS1 106/4885

“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.