Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3319243

CC(C)CN(NC(=O)c1ccc(CN2CCN(C)CC2)cc1)c1nc(C#N)ncc1Br.O=C(O)C(F)(F)F

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.90
CTSK P43235 4/20 0.90
CTSL P07711 3/20 0.90
CTSB P07858 2/20 0.90
HDAC6 Q9UBN7 1/20 0.41
TBK1 Q9UHD2 9/20 0.41
IKBKE Q14164 9/20 0.40
SLC2A1 P11166 1/20 0.37
KIT P10721 1/20 0.36
FLT3 P36888 1/20 0.36
ABL1 P00519 2/20 0.36

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
SCHEMBL5592896 0.95 CTSS (1.00) CTSSCTSKCTSLCTSBHDAC6
Trifluoroacetic Acid SCHEMBL5592848 0.94 CTSL (0.79) CTSSCTSKCTSLCTSBHDAC6
Trifluoroacetic Acid SCHEMBL5592621 0.93 CTSL (0.78) CTSSCTSKCTSLCTSBHDAC6
Trifluoroacetic Acid SCHEMBL3169501 0.90 CTSK (0.73) CTSSCTSKCTSLCTSBHDAC6
SCHEMBL5592822 0.88 CTSS (0.88) CTSSCTSKCTSLCTSBHDAC6
SCHEMBL5593246 0.88 CTSL (0.87) CTSSCTSKCTSLCTSBHDAC6
SCHEMBL5592618 0.88 CTSL (0.87) CTSSCTSKCTSLCTSBHDAC6
Trifluoroacetic Acid SCHEMBL5592914 0.88 CTSL (0.69) CTSSCTSKCTSLCTSBSLC2A1
Trifluoroacetic Acid SCHEMBL5591441 0.88 CTSS (0.69) CTSSCTSKCTSLCTSBHDAC6
SCHEMBL5593209 0.88 CTSL (0.86) CTSSCTSKCTSLCTSBHDAC6

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
WO-2007025775-A2 CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED (GB) 2007-03-08 WO claimed
US-20100105652-A1 PURINES AS CYSTEINE PROTEASE INHIBITORS GLAXO GROUP LIMITED 2010-04-29 US disclosed
EP-2028182-A1 Cysteine protease inhibitors GLAXO GROUP LIMITED (GB) 2009-02-25 EP disclosed
EP-1972630-A1 Purines as cysteine protease inhibitors GLAXO GROUP LIMITED (GB) 2008-09-24 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-20100105652-A1 PURINES AS CYSTEINE PROTEASE INHIBITORS CPN1, SERPINB1, PNP CTSS 37/4885CTSK 135/4885CTSL 31/4885

“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.