Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4844286

CC(=O)OCc1ccc(CNc2ccc(-c3nc4cc(Br)cnc4[nH]3)cc2)o1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.35
LDHB P07195 1/20 0.35
PTGS2 P35354 1/20 0.35
HAO1 Q9UJM8 1/20 0.35
HPSE Q9Y251 5/20 0.33
SIRT2 Q8IXJ6 1/20 0.32
TP53 P04637 1/20 0.32
MMP2 P08253 4/20 0.31
MMP9 P14780 4/20 0.31
MMP8 P22894 4/20 0.31
MMP13 P45452 4/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
GFER P55789 1/20 0.30
DGAT1 O75907 1/20 0.30

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
SCHEMBL5261588 0.94 LDHA (0.36) LDHALDHBPTGS2HAO1HPSE
Trifluoroacetic Acid SCHEMBL4839496 0.88 LDHA (0.38) LDHALDHBPTGS2HAO1HPSE
Trifluoroacetic Acid SCHEMBL4843563 0.81 ALDH1A1 (0.41) PTGS2TP53MMP2MMP9MMP8
SCHEMBL5257434 0.80 NPC1 (0.39) LDHALDHBPTGS2HAO1HPSE
Trifluoroacetic Acid SCHEMBL5259763 0.80 MMP2 (0.35) HPSEMMP2MMP9MMP8MMP13
Trifluoroacetic Acid SCHEMBL4837278 0.79 HPSE (0.45) HPSENPC1RAB9AKMT2A
Trifluoroacetic Acid SCHEMBL4844134 0.79 HPSE (0.36) HPSEMMP2MMP9MMP8MMP13
Trifluoroacetic Acid SCHEMBL4846619 0.79 MMP2 (0.35) HPSESIRT2TP53MMP2MMP9
SCHEMBL27614959 0.78 HPSE (0.36) LDHALDHBPTGS2HAO1HPSE
Trifluoroacetic Acid SCHEMBL4843358 0.78 ABL1 (0.44) PTGS2NPC1RAB9AKMT2A

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 LDHA 2904/4885LDHB 3184/4885PTGS2 1310/4885

“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.