Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3898518

CC(=N)N1CCC(Oc2ccc(C[C@H](NS(=O)(=O)c3ccccc3)C(=O)Nc3cccc(C(=N)N)c3)cc2)CC1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F2 P00734 14/20 0.53
TMPRSS6 Q8IU80 5/20 0.53
F10 P00742 15/20 0.51
ST14 Q9Y5Y6 12/20 0.51
PLG P00747 10/20 0.51
PLAU P00749 10/20 0.51

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 SCHEMBL3898272 0.89 F2 (0.56) F2TMPRSS6F10ST14PLG
SCHEMBL3909321 0.87 ST14 (0.62) F2TMPRSS6F10ST14PLG
SCHEMBL14132314 0.85 F10 (0.54) F2F10ST14PLGPLAU
Trifluoroacetic Acid SCHEMBL3896012 0.85 F10 (0.56) F2TMPRSS6F10ST14PLG
Trifluoroacetic Acid SCHEMBL5096319 0.85 F10 (0.49) F2TMPRSS6F10ST14PLG
SCHEMBL14132246 0.85 F2 (0.51) F2TMPRSS6F10ST14PLG
Trifluoroacetic Acid SCHEMBL3905961 0.84 F10 (0.54) F2TMPRSS6F10
Trifluoroacetic Acid SCHEMBL3909865 0.81 F10 (0.51) F2TMPRSS6F10ST14PLG
Trifluoroacetic Acid SCHEMBL3902709 0.80 F10 (0.56) F2F10ST14PLGPLAU
SCHEMBL3897206 0.80 F10 (0.52) F2F10ST14PLGPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0976722-B1 BENZAMIDINE DERIVATIVES AJINOMOTO KK (JP) 2009-03-11 EP disclosed
US-7396844-B1 Benzamidine derivatives AJINOMOTO CO., INC. (JP) 2008-07-08 US disclosed
EP-0976722-A1 BENZAMIDINE DERIVATIVES Ajinomoto Co., Inc. (JP) 2000-02-02 EP disclosed