Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5068417

O=C(O)C(F)(F)F.O=C(O)[C@@H]1C[C@@H](O)CN1

nearest known ligand 0.48

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.48
CYP1A2 P05177 2/20 0.48
ALOX15 P16050 2/20 0.48
CYP2C19 P33261 2/20 0.48
SLC1A3 P43003 1/20 0.48
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
ARG1 P05089 1/20 0.39
DPP4 P27487 4/20 0.38
DPP8 Q6V1X1 4/20 0.38
DPP9 Q86TI2 4/20 0.38
LMNA P02545 2/20 0.38
BLM P54132 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
THRB P10828 1/20 0.38
PMP22 Q01453 1/20 0.38
HPSE Q9Y251 1/20 0.36

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 SCHEMBL19064900 1.00 CYP2D6 (0.48) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
Trifluoroacetic Acid SCHEMBL17422955 1.00 CYP2D6 (0.48) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL200243 0.88
SCHEMBL1995473 0.88
SCHEMBL19307 0.88
SCHEMBL21185 0.88
SCHEMBL6858335 0.88 CYP2D6 (0.60) CYP2D6CYP1A2ALOX15CYP2C19SLC1A3
SCHEMBL2024894 0.88
SCHEMBL21184 0.88
SCHEMBL85624 0.88

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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 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-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 CYP2D6 2493/4885CYP1A2 804/4885ALOX15 1687/4885

“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.