Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3100526

CCN(CC)C(=O)C(Cc1ccc(NC(=O)C2CCNCC2)cc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.39
SLC6A2 P23975 2/20 0.39
SLC6A4 P31645 2/20 0.39
USP30 Q70CQ3 4/20 0.38
LARS1 Q9P2J5 1/20 0.38
CTSD P07339 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
F10 P00742 1/20 0.37
PLG P00747 1/20 0.37
PLAT P00750 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37

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
SCHEMBL3086225 0.91 F2 (0.44) F2USP30LARS1F10PLG
Trifluoroacetic Acid SCHEMBL3097684 0.84 F2 (0.46) F2LARS1PLG
Trifluoroacetic Acid SCHEMBL15000275 0.84 ITGB3 (0.44) F2SLC6A2SLC6A4LARS1CTSD
Trifluoroacetic Acid SCHEMBL14999886 0.84 ITGB3 (0.47) F2SLC6A2SLC6A4LARS1SLC6A3
SCHEMBL3096957 0.83 PTPN2 (0.47) F2
SCHEMBL14999923 0.82 MAPT (0.46) F2LARS1
SCHEMBL14999932 0.81 LARS1 (0.47) F2LARS1
SCHEMBL3090331 0.81 LARS1 (0.47) F2LARS1
SCHEMBL3090750 0.81 LARS1 (0.45) F2LARS1
SCHEMBL3102970 0.81 MMP9 (0.46) F2LARS1PLG

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-8461209-B2 Malonic acid sulfonamide derivative and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-06-11 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 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-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 F2 4128/4885SLC6A2 652/4885SLC6A4 1527/4885

“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.