Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5001971

COc1cccc(-c2cccc(CCC3(C)Cc4ccccc4C(N)=N3)c2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 14/20 0.68
LMNA P02545 1/20 0.39
GRM2 Q14416 1/20 0.38
GRM3 Q14832 1/20 0.38

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
SCHEMBL8241111 0.91 BACE1 (0.62) BACE1
Trifluoroacetic Acid SCHEMBL5005126 0.88 BACE1 (0.57) BACE1LMNAGRM2GRM3
SCHEMBL5028541 0.84 BACE1 (0.56) BACE1LMNA
Trifluoroacetic Acid SCHEMBL4995659 0.84 BACE1 (0.53) BACE1
Trifluoroacetic Acid SCHEMBL4997227 0.82 BACE1 (0.57) BACE1GRM2GRM3
Trifluoroacetic Acid SCHEMBL5001506 0.81 BACE1 (0.52) BACE1LMNA
Trifluoroacetic Acid SCHEMBL5007687 0.81 BACE1 (0.57) BACE1LMNA
Trifluoroacetic Acid SCHEMBL5001827 0.80 BACE1 (0.60) BACE1
Trifluoroacetic Acid SCHEMBL5001583 0.80 BACE1 (0.54) BACE1LMNA
SCHEMBL8241119 0.79 BACE1 (0.49) BACE1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293709-A1 Novel 2-Amino-Heterocycles Useful in the Treatment of Abeta-Related Pathologies ASTRAZENECA AB (SE) 2008-11-27 US claimed
EP-1957462-A2 NOVEL 2-AMINO-HETEROCYCLES UDEFUL IN THE TREATMENT OF ABETA-RELATED PATHOLOGIES Astra Zeneca AB (SE) 2008-08-20 EP claimed
WO-2007058583-A2 NOVEL 2-AMINO-HETEROCYCLES USEFUL IN THE TREATMENT OF ABETA-RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-05-24 WO claimed
US-20080293709-A1 Novel 2-Amino-Heterocycles Useful in the Treatment of Abeta-Related Pathologies ASTRAZENECA AB (SE) 2008-11-27 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-20080293709-A1 Novel 2-Amino-Heterocycles Useful in the Treatment of Abeta-Related Pathologies PSEN2, APP, PSEN1 BACE1 4/4885LMNA 1489/4885GRM2 120/4885

“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.