Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5776822

O=C(CCc1cnoc1-c1ccc(F)cc1)N1CCN(Cc2ccccc2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 2/20 0.50
DPP7 Q9UHL4 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HTT P42858 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
TSHR P16473 1/20 0.48
ALOX5 P09917 3/20 0.47
GFER P55789 1/20 0.44
APP P05067 1/20 0.42
PRKAA2 P54646 1/20 0.42

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 SCHEMBL5776847 0.88 MDM2 (0.39) DPP8DPP7MEN1KMT2AHTT
Trifluoroacetic Acid SCHEMBL5774450 0.88 HTT (0.40) DPP8DPP7HTTTSHRPRKAA2
Trifluoroacetic Acid SCHEMBL5907107 0.87 FAAH (0.51) MEN1KMT2AHTTALDH1A1MAPT
Trifluoroacetic Acid SCHEMBL5772610 0.87 GFER (0.53) MEN1KMT2AMAPTTSHRGFER
Trifluoroacetic Acid SCHEMBL5772964 0.87 TSHR (0.45) DPP8DPP7MEN1KMT2ATSHR
Trifluoroacetic Acid SCHEMBL5776834 0.86 HTT (0.46) DPP8DPP7KMT2AHTTMAPT
Trifluoroacetic Acid SCHEMBL5776836 0.86 PARP1 (0.44) MEN1KMT2AMAPTTSHRGFER
Trifluoroacetic Acid SCHEMBL5773395 0.85 LMNA (0.48) MEN1KMT2AALDH1A1MAPTTSHR
Trifluoroacetic Acid SCHEMBL5773386 0.85 LMNA (0.48) MEN1KMT2AALDH1A1MAPTTSHR
Trifluoroacetic Acid SCHEMBL5777433 0.85 GFER (0.53) MEN1KMT2AALDH1A1MAPTTSHR

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 DPP8 805/4885DPP7 554/4885MEN1 2811/4885
US-20040048908-A1 Isoxazole derivatives GPR119, INSR, IRS1 DPP8 567/4885DPP7 256/4885MEN1 2072/4885

“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.