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Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3899650

N=C(N)c1ccc(S(=O)(=O)NCCOc2cccc(C(=N)N)c2)cc1.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.59

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Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.59
▸ F2 P00734 17/20 0.59
▸ TMPRSS6 Q8IU80 9/20 0.59
▸ PLG P00747 1/20 0.52

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 SCHEMBL3910393 0.96 F2 (0.55) F10F2TMPRSS6
Trifluoroacetic Acid SCHEMBL3907682 0.93 F10 (0.53) F10F2TMPRSS6
SCHEMBL3898931 0.92 F10 (0.65) F10F2PLG
Trifluoroacetic Acid SCHEMBL3899556 0.90 F2 (0.67) F10F2TMPRSS6PLG
SCHEMBL14132042 0.89 F10 (0.61) F10F2PLG
Trifluoroacetic Acid SCHEMBL3898961 0.87 F2 (0.66) F10F2TMPRSS6PLG
SCHEMBL3910394 0.87 F2 (0.52) F10F2TMPRSS6
SCHEMBL14132247 0.85 F10 (0.55) F10F2PLG
Trifluoroacetic Acid SCHEMBL3901415 0.83 F10 (0.68) F10F2TMPRSS6PLG
Trifluoroacetic Acid SCHEMBL3895029 0.83 F10 (0.86) F10F2PLG

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