Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6600841

COc1nn(-c2ccc(NCc3cccc(Oc4cccc(C(F)(F)F)c4)c3)cc2)c(=O)o1.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.50
FAAH O00519 4/20 0.49
ABHD6 Q9BV23 1/20 0.47
LPL P06858 1/20 0.45
LIPC P11150 1/20 0.45
LIPE Q05469 1/20 0.45
FFAR1 O14842 7/20 0.44
FFAR4 Q5NUL3 2/20 0.44
GNA15 P30679 1/20 0.42
PTGER3 P43115 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ABHD16A O95870 1/20 0.41
HIF1A Q16665 1/20 0.41
SCD O00767 1/20 0.40

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 SCHEMBL6601408 0.94 MGLL (0.55) MGLLFAAHABHD6LPLLIPC
Trifluoroacetic Acid SCHEMBL6601314 0.81 MGLL (0.48) MGLLFAAHABHD6LPLLIPC
Trifluoroacetic Acid SCHEMBL6601669 0.80 MGLL (0.52) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6602539 0.78 MAPT (0.45) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6601568 0.77 LPL (0.47) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6601748 0.75 FAAH (0.44) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6599045 0.75 MGLL (0.48) MGLLFAAHABHD6LPLLIPC
Trifluoroacetic Acid SCHEMBL6599708 0.75 LPL (0.46) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6601589 0.74 ABHD16A (0.47) MGLLFAAHLPLLIPCLIPE
SCHEMBL14044105 0.74 MAPK14 (0.58) FAAHFFAR1FFAR4GNA15PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1263745-B1 SUBSTITUTED 3-PHENYL-5-ALKOXI-1,3,4-OXDIAZOL-2-ONE AND USE THEREOF FOR INHIBITING HORMONE-SENSITIVE LIPASE AVENTIS PHARMA GMBH (DE) 2004-05-19 EP disclosed