Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7220555

Nc1ccnc2ccc(CN3CC[C@H](N)C3=O)cc12.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 2/20 0.39
F10 P00742 4/20 0.37
DPP4 P27487 6/20 0.36
DPP7 Q9UHL4 6/20 0.36
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 3/20 0.36
F2 P00734 1/20 0.34
MET P08581 1/20 0.34
NR4A2 P43354 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33

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 SCHEMBL7923392 0.92 F10 (0.36) SMYD3F10DPP4DPP7F2
SCHEMBL7921805 0.91 F10 (0.42) SMYD3F10F2NR4A2
Trifluoroacetic Acid SCHEMBL7220554 0.89 MET (0.38) SMYD3F10DPP4DPP7DPP8
Trifluoroacetic Acid SCHEMBL7219247 0.86 DGAT1 (0.40) F10
Trifluoroacetic Acid SCHEMBL7213657 0.84 F10 (0.48) F10DPP4DPP7F2
Trifluoroacetic Acid SCHEMBL7540260 0.84 F10 (0.48) F10DPP4DPP7F2
Trifluoroacetic Acid SCHEMBL7213717 0.84 F10 (0.48) F10DPP4DPP7F2
Trifluoroacetic Acid SCHEMBL7214506 0.82 F10 (0.46) F10F2
SCHEMBL7921783 0.82 F10 (0.40) F10F2NR4A2
SCHEMBL6224794 0.82 F10 (0.40) F10F2NR4A2

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 4 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-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