Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5063644

CCn1c(-c2nonc2N)nc2c(C#Cc3ccccc3)ncc(OCCCCN)c21.O=C(O)C(F)(F)F

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ AKT1 P31749 18/20 0.78
▸ ROCK1 Q13464 16/20 0.78
▸ RPS6KA1 Q15418 15/20 0.78
▸ AKT2 P31751 8/20 0.69
▸ RPS6KA5 O75582 5/20 0.69
▸ AKT3 Q9Y243 3/20 0.69
▸ GSK3B P49841 1/20 0.49

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 SCHEMBL3488625 0.89 AKT1 (0.88) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5067578 0.88 AKT1 (1.00) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5063569 0.88 AKT1 (0.81) AKT1ROCK1RPS6KA1AKT2RPS6KA5
SCHEMBL5058410 0.87 AKT1 (0.61) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5062855 0.87 AKT1 (0.90) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5062857 0.87 AKT1 (0.81) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5067572 0.87 AKT1 (0.83) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL3488230 0.87 AKT1 (0.88) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5062784 0.86 AKT1 (0.80) AKT1ROCK1RPS6KA1AKT2RPS6KA5
Trifluoroacetic Acid SCHEMBL5066276 0.86 AKT1 (0.87) AKT1ROCK1RPS6KA1AKT2RPS6KA5

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-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 — — 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-20080255143-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 AKT1 5/4885ROCK1 478/4885RPS6KA1 127/4885

“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.

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