Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6107669

COc1cc2c(C(=O)O)cnc(C(=O)c3cccc(OCC(=O)N4CCOCC4)c3)c2cc1OC.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ MAPT P10636 2/20 0.44
▸ GFPT1 Q06210 1/20 0.44
▸ POLB P06746 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ IDE P14735 1/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ NFE2L2 Q16236 1/20 0.41

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
SCHEMBL5745153 0.96 FKBP1A (0.48) FKBP1AALDH1A1MAPTPOLBTP53
Trifluoroacetic Acid SCHEMBL5809778 0.93 GFPT1 (0.46) ALDH1A1MAPTGFPT1POLBSMN1; SMN2
Trifluoroacetic Acid SCHEMBL5763821 0.91 GAA (0.51) ALDH1A1MAPTGFPT1POLBSMN1; SMN2
SCHEMBL6107674 0.89 MAPT (0.45) FKBP1AALDH1A1MAPTGFPT1POLB
SCHEMBL5765120 0.88 MEN1 (0.45) ALDH1A1MAPTGFPT1POLBTP53
Trifluoroacetic Acid SCHEMBL5767572 0.88 ALDH1A1 (0.50) ALDH1A1MAPTGFPT1SMN1; SMN2KMT2A
SCHEMBL5744564 0.87 GAA (0.55) ALDH1A1MAPTGFPT1POLBTP53
SCHEMBL5766705 0.86 MAPK1 (0.51) ALDH1A1MAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL5744131 0.86 MAPK1 (0.43) ALDH1A1MAPTGFPT1TP53SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5767994 0.86 GFPT1 (0.51) GFPT1KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067529-B2 Glutamine fructose-y-phosphate amidotransferase (GFAT) inhibitors HOFFMANN-LA ROCHE INC. (US) 2006-06-27 — — US disclosed
US-20040259910-A1 Glutamine fructose-y-phosphate amidotransferase (GFAT) inhibitors BOLIN DAVID ROBERT (US) 2004-12-23 — — 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-20040259910-A1 Glutamine fructose-y-phosphate amidotransferase (GFAT) inhibitors GFPT1, GLS2, GLS FKBP1A 2830/4885ALDH1A1 1211/4885MAPT 1626/4885

“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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