Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7320899

COc1c(CCN)c2cc(-c3ccc(C(C)(C)C)cc3)ccc2n1S(=O)(=O)c1cccs1.O=C(O)C(F)(F)F

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 2/20 0.33
HTR6 P50406 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
PPARG P37231 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
SLC1A3 P43003 1/20 0.32
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
GCKR Q14397 7/20 0.32
PKM P14618 1/20 0.32
TP53 P04637 1/20 0.32
PTGDR2 Q9Y5Y4 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
Trifluoroacetic Acid SCHEMBL7313830 0.76 PTGDR (0.45) HTR6PPARGALDH1A1PKMPTGDR2
Trifluoroacetic Acid SCHEMBL7307520 0.72 PTGDR2 (0.38) HTR6PPARGPTGDR2
Trifluoroacetic Acid SCHEMBL7549610 0.71 TP53 (0.32) SCN5ASCN9AALDH1A1MAPTTP53
Trifluoroacetic Acid SCHEMBL7307842 0.71 PTGDR (0.43) HTR6PPARGALDH1A1PTGDR2
Trifluoroacetic Acid SCHEMBL7397740 0.69 MALT1 (0.31) ALDH1A1MAPTTP53
Trifluoroacetic Acid SCHEMBL7312753 0.66 MDM2 (0.39) SERPINE1PPARGPTGDR2
Trifluoroacetic Acid SCHEMBL7318205 0.65 ICMT (0.41) PPARG
Trifluoroacetic Acid SCHEMBL7316949 0.62 ABCB11 (0.40)
Oxalic Acid SCHEMBL7441783 0.61 HTR6 (0.71) HTR6PPARG
Trifluoroacetic Acid SCHEMBL6177349 0.59 HTR6 (0.47) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010007877-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION 2001-07-12 US claimed
WO-2001034146-A1 NOVEL ANTI-INFECTIVES SMITHKLINE BEECHAM CORPORATION (US) 2001-05-17 WO claimed
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 SERPINE1 624/4885HTR6 4503/4885SCN5A 4840/4885

“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.