Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7157237

COc1ccc(S(=O)(=O)Nc2ccc(Oc3ccc4cc(C#N)ccc4c3)c(-c3ccc(OCC(C)C)cc3C(=O)O)c2)cc1F.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 11/20 0.39
SLC22A12 Q96S37 4/20 0.39
SCN9A Q15858 1/20 0.36
PLAU P00749 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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 SCHEMBL7150670 0.90 PLA2G7 (0.41) PLA2G7SLC22A12SCN9A
Trifluoroacetic Acid SCHEMBL7155223 0.89 PLA2G7 (0.43) PLA2G7SLC22A12PLAUMEN1KMT2A
Trifluoroacetic Acid SCHEMBL7153794 0.88 BRD4 (0.40) PLA2G7SCN9A
Trifluoroacetic Acid SCHEMBL7150674 0.86 PLA2G7 (0.37) PLA2G7SLC22A12SCN9AMEN1KMT2A
SCHEMBL6294972 0.85 PLAU (0.47) PLA2G7SLC22A12SCN9APLAUMEN1
SCHEMBL6295040 0.84 BRD4 (0.43) PLA2G7SLC22A12SCN9A
Trifluoroacetic Acid SCHEMBL7150647 0.80 PLA2G7 (0.44) PLA2G7SLC22A12MEN1KMT2A
Trifluoroacetic Acid SCHEMBL7153144 0.78 BRD4 (0.43) PLA2G7SCN9A
Trifluoroacetic Acid SCHEMBL6300629 0.76 PLA2G7 (0.44) PLA2G7
Trifluoroacetic Acid SCHEMBL7155334 0.76 PLA2G7 (0.40) PLA2G7SLC22A12MEN1KMT2A

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