Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3159606

CN(CC(=O)N(C)C)Cc1ccc(C(=O)NN(c2nc(C#N)ncc2Cl)C2CCCC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.40
CTSS P25774 5/20 0.40
CTSK P43235 5/20 0.40
CTSB P07858 1/20 0.40
S1PR1 P21453 2/20 0.34
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
F10 P00742 1/20 0.33
HTR5A P47898 2/20 0.32
KCNH2 Q12809 1/20 0.32
MCHR1 Q99705 1/20 0.32
GCGR P47871 1/20 0.31
GIPR P48546 1/20 0.31
TRPM8 Q7Z2W7 1/20 0.31
ITK Q08881 1/20 0.31
SLC2A1 P11166 1/20 0.31

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
SCHEMBL3176006 0.95 CTSK (0.43) CTSLCTSSCTSKCTSBS1PR1
Trifluoroacetic Acid SCHEMBL3176661 0.92 CTSK (0.39) CTSLCTSSCTSKCTSBS1PR1
Trifluoroacetic Acid SCHEMBL3159443 0.91 CTSL (0.39) CTSLCTSSCTSKCTSBS1PR1
Trifluoroacetic Acid SCHEMBL3159557 0.90 CTSL (0.39) CTSLCTSSCTSKCTSBS1PR1
Trifluoroacetic Acid SCHEMBL3160139 0.90 CTSL (0.39) CTSLCTSSCTSKCTSBLMNA
Trifluoroacetic Acid SCHEMBL3959334 0.90 CTSL (0.38) CTSLCTSSCTSKCTSBS1PR1
Trifluoroacetic Acid SCHEMBL3169472 0.89 CTSK (0.40) CTSLCTSSCTSKCTSBLMNA
Trifluoroacetic Acid SCHEMBL3166098 0.89 CTSL (0.38) CTSLCTSSCTSKCTSBLMNA
Trifluoroacetic Acid SCHEMBL3170131 0.89 CTSL (0.42) CTSLCTSSCTSKCTSBLMNA
Trifluoroacetic Acid SCHEMBL3165271 0.89 CTSL (0.38) CTSLCTSSCTSKCTSBLMNA

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-20100009956-A1 NOVEL SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS Glaxo Group Limited , a corporation 2010-01-14 US claimed
EP-2030621-A1 Novel substituted pyrimidines as cysteine protease inhibitors GLAXO GROUP LIMITED (GB) 2009-03-04 EP claimed
US-20100009956-A1 NOVEL SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS Glaxo Group Limited , a corporation 2010-01-14 US disclosed
EP-2030621-A1 Novel substituted pyrimidines as cysteine protease inhibitors GLAXO GROUP LIMITED (GB) 2009-03-04 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 (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-20100009956-A1 NOVEL SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS SERPINB1, CTRL, PRSS1 CTSL 9/4885CTSS 15/4885CTSK 65/4885

“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.