Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7213617

N[C@H]1CCN(Cc2csc3c(O)nccc23)C1=O.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 4/20 0.34
HRH3 Q9Y5N1 4/20 0.34
DPP4 P27487 7/20 0.32
DPP7 Q9UHL4 6/20 0.32
F10 P00742 2/20 0.32
F2 P00734 1/20 0.32
PLG P00747 1/20 0.32
PLAT P00750 1/20 0.32
PROC P04070 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
DPP8 Q6V1X1 5/20 0.31
DPP9 Q86TI2 5/20 0.31
CYP2D6 P10635 1/20 0.30
KCNH2 Q12809 1/20 0.30

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 SCHEMBL7453281 1.00 HRH4 (0.34) HRH4HRH3DPP4DPP7F10
Trifluoroacetic Acid SCHEMBL7457544 0.90 F10 (0.35) HRH4HRH3DPP4DPP7F10
Trifluoroacetic Acid SCHEMBL7215793 0.90 F10 (0.35) HRH4HRH3DPP4DPP7F10
Trifluoroacetic Acid SCHEMBL7213615 0.89 L3MBTL1 (0.32) HRH4HRH3F10F2PLG
Trifluoroacetic Acid SCHEMBL7453206 0.85 HRH4 (0.34) HRH4HRH3DPP4DPP7F10
Trifluoroacetic Acid SCHEMBL7213548 0.85 HRH4 (0.34) HRH4HRH3DPP4DPP7F10
Trifluoroacetic Acid SCHEMBL7446703 0.80 KDR (0.36) HRH4HRH3DPP4DPP7F10
Trifluoroacetic Acid SCHEMBL7219133 0.80 KDR (0.36) HRH4HRH3DPP4DPP7F10
SCHEMBL7214401 0.79 F10 (0.38) F10F2PLGPLATPROC
SCHEMBL7448318 0.79 F10 (0.38) F10F2PLGPLATPROC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944386-B1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP claimed
US-6281227-B1 INHIBITORS OF THE ACTIVITY OF FACTOR XA. AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-08-28 US claimed
US-6602864-B1 Sulfonic acid or sulfonylamino N-(heteroaralkyl)-azaheterocyclylamide compounds AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-08-05 US disclosed
EP-0944386-B1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA INC (US) 2002-09-18 EP disclosed
US-6281227-B1 INHIBITORS OF THE ACTIVITY OF FACTOR XA. AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-08-28 US disclosed
WO-2001039759-A2 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-06-07 WO disclosed