Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4102103

O=C(CN1CCNCC1)Nc1ccc(Cl)c(NC2=NC(=O)C(=Cc3ccc4ncccc4c3)S2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 1/20 0.39
DYRK3 O43781 2/20 0.39
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
PIK3CD O00329 1/20 0.36
PIM1 P11309 1/20 0.36
CSNK2A2 P19784 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CG P48736 1/20 0.36
CLK1 P49759 1/20 0.36
CLK3 P49761 1/20 0.36
CSNK2B P67870 1/20 0.36
CSNK2A1 P68400 1/20 0.36
DYRK1A Q13627 1/20 0.36
HASPIN Q8TF76 1/20 0.36
DYRK2 Q92630 1/20 0.36
MYLK2 Q9H1R3 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36

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 SCHEMBL4102095 1.00 OGA (0.39) OGADYRK3MAPTALDH1A1LMNA
SCHEMBL2991245 0.95 OGA (0.42) OGADYRK3MAPTALDH1A1LMNA
SCHEMBL2991247 0.95 OGA (0.42) OGADYRK3MAPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4093894 0.95 OGA (0.40) OGADYRK3MAPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4093888 0.95 OGA (0.40) OGADYRK3MAPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4091117 0.94 OGA (0.39) OGADYRK3MAPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4091128 0.94 OGA (0.39) OGADYRK3MAPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4095080 0.93 WNT3A (0.40) OGADYRK3MAPTALDH1A1LMNA
Trifluoroacetic Acid SCHEMBL4095073 0.93 WNT3A (0.40) OGADYRK3MAPTALDH1A1LMNA
SCHEMBL2985523 0.90 OGA (0.43) OGADYRK3ALDH1A1PIK3CDPIM1

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-20090203692-A1 NOVEL CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-08-13 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-20090203692-A1 NOVEL CHEMICAL COMPOUNDS HIPK3, HIPK1, HIPK4 OGA 1432/4885DYRK3 1471/4885MAPT 1880/4885

“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.