Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7152805

Cc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc4cc(C(=N)N)ccc4c3)c(-c3ccc(C(=O)NCC(C)C)cc3C(=O)O)c2)cc1Cl.O=C(O)C(F)(F)F

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F3 P13726 19/20 0.48
F2 P00734 17/20 0.48
F7 P08709 14/20 0.47
F10 P00742 14/20 0.47
PLG P00747 6/20 0.47
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44

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 SCHEMBL7156665 0.95 F3 (0.49) F3F2F7F10PLG
Trifluoroacetic Acid SCHEMBL7157111 0.90 F3 (0.53) F3F2F7F10PLG
Trifluoroacetic Acid SCHEMBL6296048 0.88 F3 (0.54) F3F2F7F10PLG
Trifluoroacetic Acid SCHEMBL6295012 0.87 PLA2G7 (0.41) F3F2F7F10PRSS1
SCHEMBL8506169 0.83 F3 (0.57) F3F2F7F10PLG
SCHEMBL8475188 0.83 PRSS1 (0.44) F2PRSS1PRSS2PRSS3
Trifluoroacetic Acid SCHEMBL6300715 0.80 F3 (0.55) F3F2F7F10PLG
Trifluoroacetic Acid SCHEMBL7150670 0.78 PLA2G7 (0.41)
Trifluoroacetic Acid SCHEMBL7151193 0.78 PRSS1 (0.51) F3F2F10PRSS1PRSS2
Trifluoroacetic Acid SCHEMBL6294978 0.77 F2 (0.49) F3F2F7F10PRSS1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1312602-A1 Amidino derivatives, and anticoagulants and thrombosis therapeutic agents containing them Eisai Co., Ltd. (JP) 2003-05-21 EP disclosed