Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29453049

COc1cc2nc(Cl)nc(N[C@H]3CCCNC3)c2cc1OC.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
WHR1 P49842 4/20 0.55
EHMT2 Q96KQ7 7/20 0.53
CHEK1 O14757 4/20 0.50
CHEK2 O96017 4/20 0.50
CCR4 P51679 1/20 0.47
NSD2 O96028 2/20 0.45
EGFR P00533 2/20 0.43
KDR P35968 2/20 0.43
HTT P42858 1/20 0.43

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 SCHEMBL29453050 1.00 WHR1 (0.55) WHR1EHMT2CHEK1CHEK2CCR4
SCHEMBL20602868 0.90 EHMT2 (0.64) EHMT2CHEK1CHEK2CCR4NSD2
SCHEMBL20602878 0.90 EHMT2 (0.64) EHMT2CHEK1CHEK2CCR4NSD2
SCHEMBL20602869 0.90 EHMT2 (0.64) EHMT2CHEK1CHEK2CCR4NSD2
Trifluoroacetic Acid SCHEMBL20602884 0.86 WHR1 (0.70) WHR1EHMT2CCR4
Trifluoroacetic Acid SCHEMBL29453062 0.86 WHR1 (0.70) WHR1EHMT2CCR4
Trifluoroacetic Acid SCHEMBL22026553 0.86 WHR1 (0.70) WHR1EHMT2CCR4
Trifluoroacetic Acid SCHEMBL4969262 0.79 IRAK4 (0.53) WHR1EHMT2CHEK1CHEK2NSD2
Trifluoroacetic Acid SCHEMBL20602889 0.79 EHMT2 (0.62) WHR1EHMT2NSD2
SCHEMBL12526929 0.78 EHMT2 (0.72) EHMT2CHEK1CHEK2CCR4NSD2

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-11254654-B2 Heterochromatin gene repression inhibitors THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2022-02-22 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-11254654-B2 Heterochromatin gene repression inhibitors CTCF, EHMT2, CBX3 WHR1 158/4885EHMT2 2/4885CHEK1 806/4885

“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.