Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5203534

CC(=O)Nc1ccc(CN(C(=O)CCC(=O)NCc2cccc3ccccc23)c2ccccc2Oc2cccc(CN)c2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.37
MEN1 O00255 5/20 0.37
TPSAB1 Q15661 2/20 0.36
POLB P06746 1/20 0.36
FDPS P14324 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
PSMB8 P28062 1/20 0.35
PSMB5 P28074 1/20 0.35
MAPK1 P28482 1/20 0.35
NR2E3 Q9Y5X4 1/20 0.35
P2RX4 Q99571 1/20 0.35
MAPT P10636 1/20 0.34
FAAH O00519 1/20 0.34

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 SCHEMBL5205308 0.93 TPSAB1 (0.38) KMT2AMEN1TPSAB1PSMB8PSMB5
Trifluoroacetic Acid SCHEMBL5205693 0.92 CSF1R (0.39) KMT2ATPSAB1L3MBTL1P2RX4
Trifluoroacetic Acid SCHEMBL5202539 0.92 ALDH1A1 (0.38) KMT2AMEN1TPSAB1POLBL3MBTL1
Trifluoroacetic Acid SCHEMBL5208616 0.92 TSPO (0.38) KMT2AMEN1TPSAB1PSMB8PSMB5
Trifluoroacetic Acid SCHEMBL5202242 0.90 TPSAB1 (0.37) KMT2AMEN1TPSAB1PSMB8PSMB5
Trifluoroacetic Acid SCHEMBL5201456 0.90 ALDH1A1 (0.44) KMT2AMEN1TPSAB1L3MBTL1
Trifluoroacetic Acid SCHEMBL5205606 0.90 TSPO (0.38) KMT2AMEN1PSMB8PSMB5MAPK1
Trifluoroacetic Acid SCHEMBL5208564 0.90 TPSAB1 (0.37) KMT2AMEN1TPSAB1POLBL3MBTL1
Trifluoroacetic Acid SCHEMBL5206365 0.89 KMT2A (0.39) KMT2AMEN1TPSAB1POLBL3MBTL1
Trifluoroacetic Acid SCHEMBL5203223 0.89 NAMPT (0.40) KMT2AMEN1MAPK1MAPT

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
US-7160887-B1 Aromatic amine derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-09 US disclosed
EP-1123918-B1 AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME TAKEDA PHARMACEUTICAL (JP) 2005-03-09 EP disclosed
EP-1123918-A1 AROMATIC AMINE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME Takeda Chemical Industries, Ltd. (JP) 2001-08-16 EP disclosed