Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29908226

C(#Cc1ccnc(-c2ccnc(N3CC(c4ccccc4)C3)n2)n1)c1ccc2[nH]ncc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACACB O00763 6/20 0.40
ROCK2 O75116 5/20 0.37
ROCK1 Q13464 1/20 0.37
PDE10A Q9Y233 1/20 0.36
HAO1 Q9UJM8 2/20 0.36
GRIN1 Q05586 2/20 0.34
GRIN2B Q13224 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
HCRTR1 O43613 2/20 0.34
HCRTR2 O43614 2/20 0.34

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 SCHEMBL29628004 0.93 ROCK2 (0.37) ACACBROCK2HAO1
Trifluoroacetic Acid SCHEMBL29627872 0.91 ACACB (0.38) ACACBROCK2HAO1TRPV1
Trifluoroacetic Acid SCHEMBL29640908 0.90 KDM1A (0.34) ACACBROCK2ROCK1PDE10AHAO1
SCHEMBL29627898 0.89 HAO1 (0.39) ACACBROCK2ROCK1PDE10AHAO1
Trifluoroacetic Acid SCHEMBL29640799 0.88 ACACB (0.36) ACACBROCK2ROCK1PDE10AHAO1
SCHEMBL29908258 0.87 ROCK2 (0.44) ACACBROCK2ROCK1PDE10AGRIN1
SCHEMBL29640823 0.85 HAO1 (0.38) ACACBROCK2ROCK1PDE10AHAO1
SCHEMBL29627921 0.85 ROCK2 (0.38) ROCK2ROCK1PDE10A
SCHEMBL29627883 0.85 ACACB (0.46) ACACBROCK2ROCK1PDE10AGRIN1
Trifluoroacetic Acid SCHEMBL29627947 0.84 ROCK2 (0.42) ROCK2ROCK1HAO1TRPV1

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-20220281841-A1 ETHYNYLHETEROCYCLES AS RHO-ASSOCIATED COILED-COIL KINASE (ROCK) INHIBITORS ANGION BIOMEDICA CORP. 2022-09-08 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-20220281841-A1 ETHYNYLHETEROCYCLES AS RHO-ASSOCIATED COILED-COIL KINASE (ROCK) INHIBITORS ROCK1, ROCK2, CIT ACACB 1634/4885ROCK2 2/4885ROCK1 1/4885

“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.