Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL841933

CC(NC(=O)CC(=O)Nc1ccc(C(=N)N)cc1)c1ccc(S(=O)(=O)N2CCOCC2)c(C(F)(F)F)c1.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
F7 P08709 9/20 0.58
F2 P00734 7/20 0.58
GSTO1 P78417 1/20 0.49
CNR2 P34972 1/20 0.42
GALR3 O60755 1/20 0.42
RAB9A P51151 1/20 0.42
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TMPRSS6 Q8IU80 1/20 0.40
ALDH1A1 P00352 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
F10 P00742 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL860318 0.97 F7 (0.61) F7F2GSTO1CNR2GALR3
SCHEMBL860541 0.97 F7 (0.61) F7F2GSTO1CNR2GALR3
SCHEMBL861281 0.94 F7 (0.58) F7F2GSTO1CNR2GALR3
SCHEMBL860930 0.90 F7 (0.54) F7F2GSTO1GAAALDH1A1
SCHEMBL860971 0.90 F7 (0.54) F7F2GSTO1GAAALDH1A1
SCHEMBL861204 0.89 F7 (0.53) F7F2GSTO1CNR2GAA
SCHEMBL861060 0.88 F7 (0.52) F7F2GSTO1GAAALDH1A1
SCHEMBL878998 0.87 F7 (0.54) F7F2GSTO1GAAALDH1A1
SCHEMBL860994 0.86 F7 (0.51) F7F2GSTO1GAAALDH1A1
SCHEMBL860345 0.86 F7 (0.51) F7F2GSTO1GAAALDH1A1

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
EP-2176223-B1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI SA (FR) 2013-01-23 EP disclosed
US-8143242-B2 Malonamide derivatives with antithrombotic activity SANOFI-AVENTIS (FR) 2012-03-27 US disclosed
US-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY SANOFI-AVENTIS (FR) 2010-09-30 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-20100249101-A1 MALONAMIDE DERIVATIVES WITH ANTITHROMBOTIC ACTIVITY F7, F9, TFPI F7 1/4885F2 23/4885GSTO1 3547/4885

“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.