Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5794082

CC(C)CN(c1ccnc(C#N)n1)N(CCCl)C(N)=O.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSK P43235 4/20 0.36
CTSS P25774 2/20 0.32
FGFR4 P22455 1/20 0.30

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 SCHEMBL5791564 0.90 CTSK (0.35) CTSKFGFR4
Trifluoroacetic Acid SCHEMBL5791710 0.89 CTSK (0.38) CTSKCTSSFGFR4
Trifluoroacetic Acid SCHEMBL5791177 0.88 CTSK (0.42) CTSKCTSS
Trifluoroacetic Acid SCHEMBL5792598 0.86 CTSK (0.48) CTSKCTSS
SCHEMBL5804672 0.84 CTSK (0.36) CTSKFGFR4
SCHEMBL5792640 0.84 CTSK (0.36) CTSKFGFR4
Trifluoroacetic Acid SCHEMBL5792731 0.82 CTSK (0.35) CTSKCTSS
SCHEMBL5792575 0.78 CTSK (0.44) CTSKCTSSFGFR4
SCHEMBL5791034 0.78 CTSK (0.42) CTSKCTSSFGFR4
SCHEMBL5793393 0.76 CTSK (0.41) CTSKFGFR4

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
WO-2006027211-A1 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 2006-03-16 WO claimed
WO-2006027211-A1 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 2006-03-16 WO disclosed