Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6056715

Cc1ccc(CN(CCCN2CCC(Cc3ccccc3)CC2)C(=O)NC2CCCCC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 3/20 0.51
OPRM1 P35372 4/20 0.49
MEN1 O00255 2/20 0.49
HTT P42858 2/20 0.49
KMT2A Q03164 2/20 0.49
GAA P10253 2/20 0.49
TMEM97 Q5BJF2 1/20 0.49
CCR3 P51677 1/20 0.48
MCHR1 Q99705 5/20 0.47
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
USP2 O75604 1/20 0.46
HRH3 Q9Y5N1 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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 SCHEMBL6056707 0.95 OPRM1 (0.52) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056742 0.93 CCR3 (0.57) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056780 0.92 SLC2A1 (0.49) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056787 0.91 OPRM1 (0.53) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056754 0.88 SLC2A1 (0.48) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056748 0.87 MEN1 (0.50) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056728 0.87 ALDH1A1 (0.47) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056717 0.87 SLC6A2 (0.48) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056644 0.87 CCR3 (0.48) SLC2A1OPRM1MEN1HTTKMT2A
Trifluoroacetic Acid SCHEMBL6056753 0.86 MEN1 (0.46) SLC2A1OPRM1MEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1219605-B1 UREA COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF TAKEDA PHARMACEUTICAL (JP) 2006-05-10 EP disclosed
EP-1219605-A1 UREA COMPOUNDS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2002-07-03 EP disclosed