Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6794973

O=C(O)C(F)(F)F.O=C1NCCn2nc3c(c21)CCc1cnc(CCc2ccc(Cl)cc2)cc1-3

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.34
CSNK1A1 P48729 1/20 0.34
CSNK1D P48730 1/20 0.34
CSNK1G2 P78368 1/20 0.34
PRCP P42785 7/20 0.33
KCNH2 Q12809 1/20 0.32
TMEM97 Q5BJF2 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
F10 P00742 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
CNR1 P21554 1/20 0.31
GUCY1A1 Q02108 1/20 0.31
GUCY1B1 Q02153 1/20 0.31
MAP4K4 O95819 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 SCHEMBL6794131 0.94 GRM2 (0.33) HRH1PRCPKCNH2TMEM97SIGMAR1
Trifluoroacetic Acid SCHEMBL6787950 0.93 PARP1 (0.35) CSNK1A1CSNK1DCSNK1G2PRCPTMEM97
Trifluoroacetic Acid SCHEMBL6791463 0.86 HRH4 (0.31)
Trifluoroacetic Acid SCHEMBL6793473 0.85 ALDH1A1 (0.33)
Trifluoroacetic Acid SCHEMBL6794140 0.84 PIM1 (0.35) TMEM97SIGMAR1
Trifluoroacetic Acid SCHEMBL4270922 0.80 MAPKAPK2 (0.36)
Trifluoroacetic Acid SCHEMBL4258570 0.79 CCNA2 (0.40) CSNK1A1CSNK1DCSNK1G2
Trifluoroacetic Acid SCHEMBL6794975 0.79 PIM1 (0.36)
SCHEMBL4260268 0.78 HTR2B (0.43) TMEM97SIGMAR1
Trifluoroacetic Acid SCHEMBL6794506 0.78 HRH4 (0.36)

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
US-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 PHARMACIA CORPORATION 2004-07-01 US claimed

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-20040127492-A1 Cyclic pyrazoles for the inhibition of mitogen activated protein kinase-activated protein kinase-2 MKNK2, MAPKAPK2, MAP3K2 HRH1 2236/4885CSNK1A1 157/4885CSNK1D 253/4885

“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.