Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6699484

Nc1nc2ccccc2c2c1ncn2CCOCC#Cc1ncccn1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 13/20 0.47
NUDT1 P36639 2/20 0.44
PDE4D Q08499 2/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
HRH2 P25021 1/20 0.44
ADRA1D P25100 1/20 0.44
HTR2A P28223 1/20 0.44
ADORA2A P29274 1/20 0.44
ADRA1A P35348 1/20 0.44
HTR2B P41595 1/20 0.44
KCNH2 Q12809 1/20 0.44
TLR8 Q9NR97 7/20 0.35
MET P08581 2/20 0.33
SERPINA3 P01011 1/20 0.33
HTT P42858 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL6699137 0.92 TLR7 (0.51) TLR7NUDT1PDE4DLMNAPOLB
Trifluoroacetic Acid SCHEMBL6700056 0.92 TLR7 (0.46) TLR7NUDT1PDE4DLMNAPOLB
Trifluoroacetic Acid SCHEMBL6699246 0.90 TLR7 (0.46) TLR7NUDT1PDE4DLMNAPOLB
Trifluoroacetic Acid SCHEMBL6699837 0.87 TLR7 (0.44) TLR7NUDT1PDE4DLMNAPOLB
Trifluoroacetic Acid SCHEMBL6704808 0.83 TLR7 (0.41) TLR7NUDT1PDE4DLMNAPOLB
SCHEMBL6699310 0.83 TLR7 (0.49) TLR7NUDT1PDE4DLMNAPOLB
SCHEMBL6104248 0.82 TLR7 (0.53) TLR7NUDT1PDE4DLMNAPOLB
Hydrochloric Acid SCHEMBL6104085 0.81 TLR7 (0.52) TLR7NUDT1PDE4DLMNAPOLB
SCHEMBL6105203 0.81 TLR7 (0.47) TLR7NUDT1PDE4DLMNAPOLB
SCHEMBL6700269 0.81 TLR7 (0.49) TLR7NUDT1PDE4DLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040072858-A1 Heterocyclic ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-04-15 US disclosed
US-6664260-B2 Viricides; anticarcinogneic agents; induction cytokine biosynthesis 3M INNOVATIVE PROPERTIES COMPANY 2003-12-16 US disclosed
EP-1339715-A2 HETEROCYCLIC ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M Innovative Properties Company (US) 2003-09-03 EP disclosed
US-20030065005-A1 Heterocyclic ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-04-03 US disclosed
WO-2002046193-A2 HETEROCYCLIC ETHER SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-06-13 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 (2 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-20030065005-A1 Heterocyclic ether substituted imidazoquinolines IFNG, IL2, IRF3 TLR7 35/4885NUDT1 844/4885PDE4D 3805/4885
US-20040072858-A1 Heterocyclic ether substituted imidazoquinolines IFNG, IL2, IRF3 TLR7 35/4885NUDT1 844/4885PDE4D 3805/4885

“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.