Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5776657

CN(C)CCNC(=O)CCc1cnoc1-c1ccc(C(F)(F)F)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
HDAC1 Q13547 2/20 0.42
HDAC4 P56524 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TRPV1 Q8NER1 8/20 0.39
TP53 P04637 2/20 0.37
UTS2R Q9UKP6 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HDAC2 Q92769 1/20 0.35
FFAR1 O14842 1/20 0.35

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 SCHEMBL5777437 0.91 ACKR3 (0.41) MAPTHDAC1HDAC4HDAC6SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5772750 0.87 MAPT (0.40) MAPTTRPV1SMN1; SMN2HPGDTSHR
Trifluoroacetic Acid SCHEMBL5771103 0.86 HDAC4 (0.36) MAPTHDAC1HDAC4TRPV1TP53
Trifluoroacetic Acid SCHEMBL5774050 0.86 TRPV1 (0.43) MAPTHDAC1HDAC6TRPV1TP53
Trifluoroacetic Acid SCHEMBL5775717 0.85 GSK3B (0.44) TRPV1TP53SMN1; SMN2FFAR1
Trifluoroacetic Acid SCHEMBL5775554 0.85 HDAC4 (0.43) MAPTHDAC1HDAC4HDAC6TRPV1
Trifluoroacetic Acid SCHEMBL5776374 0.83 MAPT (0.53) MAPTTP53SMN1; SMN2HPGDTSHR
Trifluoroacetic Acid SCHEMBL5772978 0.82 GSK3B (0.52) MAPTHDAC1HDAC6TRPV1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5773866 0.81 ALDH1A1 (0.48) MAPTTP53SMN1; SMN2
Trifluoroacetic Acid SCHEMBL5775794 0.81 KCNH2 (0.38) MAPTSMN1; SMN2HPGDTSHR

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-20060084690-A1 Isoxazole derivatives MOMOSE YU 2006-04-20 US disclosed
US-7022725-B2 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-04 US disclosed
US-20040048908-A1 Isoxazole derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-03-11 US disclosed
EP-1340749-A1 ISOXAZOLE DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 2003-09-03 EP 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 (2 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-20060084690-A1 Isoxazole derivatives INSR, GPR119, INSRR MAPT 4701/4885HDAC1 353/4885HDAC4 434/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 MAPT 4763/4885HDAC1 184/4885HDAC4 497/4885

“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.