Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4842767

O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.OC1(c2ccccc2)CCN(CCOc2ccc(-c3nc4cc(Br)cnc4[nH]3)cc2)CC1

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.46
ACHE P22303 8/20 0.44
CHEK2 O96017 2/20 0.42
TBK1 Q9UHD2 1/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
AR P10275 1/20 0.40
DRD3 P35462 3/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL4842188 0.94 LTA4H (0.51) LTA4HACHECHEK2TBK1MEN1
Trifluoroacetic Acid SCHEMBL4842116 0.89 CHEK2 (0.53) ACHECHEK2TBK1
Trifluoroacetic Acid SCHEMBL4845497 0.88 ABCB1 (0.44) ALDH1A1
Trifluoroacetic Acid SCHEMBL4842301 0.87 DRD2 (0.54) ACHECHEK2TBK1DRD3DRD2
SCHEMBL6218461 0.87 TBK1 (0.44) LTA4HACHECHEK2TBK1MEN1
Trifluoroacetic Acid SCHEMBL4841456 0.87 CHEK2 (0.45) ACHECHEK2TBK1DRD3DRD2
Trifluoroacetic Acid SCHEMBL4843197 0.87 TBK1 (0.51) ACHECHEK2TBK1ALDH1A1DRD3
Trifluoroacetic Acid SCHEMBL4841636 0.86 ACHE (0.53) ACHECHEK2TBK1
Trifluoroacetic Acid SCHEMBL4840800 0.86 CHEK2 (0.45) ACHECHEK2TBK1DRD3
Trifluoroacetic Acid SCHEMBL4846269 0.85 CHEK2 (0.44) ACHECHEK2TBK1

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-7410966-B2 Use of and some novel imidazopyridines ASTRAZENECA AB (SE) 2008-08-12 US disclosed
EP-1539759-B1 NOVEL IMIDAZOPYRIDINES AND THEIR USE ASTRAZENECA AB (SE) 2007-08-15 EP disclosed
US-20050261333-A1 Use of and some novel imidazopyridines ASTRAZENECA A B (SE) 2005-11-24 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-20050261333-A1 Use of and some novel imidazopyridines ITK, CSNK1A1, RPS6KA1 LTA4H 2694/4885ACHE 1390/4885CHEK2 309/4885

“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.