Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7314734

COc1c(CCN)c2cc(-c3cccc(C#N)c3)ccc2n1Cc1ccc(C(=O)O)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.38
PLA2G2A P14555 5/20 0.38
SLC2A1 P11166 1/20 0.38
ALOX5AP P20292 1/20 0.38
PTGES2 Q9H7Z7 6/20 0.36
ADAM17 P78536 1/20 0.36
PPARG P37231 1/20 0.35
PTGES O14684 2/20 0.35
CCR2 P41597 1/20 0.35
TBXAS1 P24557 1/20 0.35
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35

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 SCHEMBL7312753 0.92 MDM2 (0.39) PLA2G2ASLC2A1ALOX5APPTGES2ADAM17
Trifluoroacetic Acid SCHEMBL7315970 0.91 CCR2 (0.41) PLA2G2ASLC2A1ALOX5APPTGES2ADAM17
Trifluoroacetic Acid SCHEMBL7316949 0.83 ABCB11 (0.40) PLA2G2APTGES2ADAM17PTGESCCR2
Trifluoroacetic Acid SCHEMBL7318205 0.83 ICMT (0.41) PLA2G2APPARG
Trifluoroacetic Acid SCHEMBL7585777 0.77 EGFR (0.46) PLA2G2AALOX5APPPARG
Trifluoroacetic Acid SCHEMBL3750230 0.66 FFAR1 (0.49) SLC2A1
SCHEMBL2034067 0.65 XDH (0.65) MMP12MMP13
SCHEMBL29788150 0.65 XDH (0.65) MMP12MMP13
Trifluoroacetic Acid SCHEMBL7403856 0.63 PTGDR2 (0.40) SLC2A1MMP12MMP13
SCHEMBL7603613 0.62 RARA (0.55)

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
US-20020004198-A1 Novel anti-infectives SMITHKLINE BEECHAM CORPORATION 2002-01-10 US disclosed
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US 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-20010007877-A1 NOVEL ANTI-INFECTIVES CTSL, MMP8, SERPINB1 AR 4866/4885PLA2G2A 2102/4885SLC2A1 4633/4885

“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.