Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6602539

CCOc1cc(CNc2ccc(-n3nc(OC)oc3=O)cc2)ccc1OC.O=C(O)C(F)(F)F

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.45
KDM4E B2RXH2 5/20 0.45
ALDH1A1 P00352 5/20 0.45
LIPC P11150 2/20 0.44
LIPE Q05469 2/20 0.44
APAF1 O14727 1/20 0.44
LPL P06858 1/20 0.44
POLB P06746 3/20 0.43
THRB P10828 1/20 0.43
ABHD16A O95870 1/20 0.43
F2 P00734 1/20 0.43
F10 P00742 1/20 0.43
PRSS1 P07477 1/20 0.43
F7 P08709 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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 SCHEMBL6601748 0.81 FAAH (0.44) LIPCLIPELPLABHD16AL3MBTL1
Trifluoroacetic Acid SCHEMBL6601669 0.80 MGLL (0.52) MAPTLIPCLIPELPLABHD16A
Trifluoroacetic Acid SCHEMBL6600841 0.78 MGLL (0.50) KDM4ELIPCLIPELPLABHD16A
Trifluoroacetic Acid SCHEMBL6599708 0.77 LPL (0.46) LIPCLIPELPLABHD16AL3MBTL1
Trifluoroacetic Acid SCHEMBL6599045 0.74 MGLL (0.48) LIPCLIPELPLABHD16AFAAH
Trifluoroacetic Acid SCHEMBL6604365 0.73 MGLL (0.46) LIPCLIPELPLABHD16AFAAH
Trifluoroacetic Acid SCHEMBL6601368 0.73 MGLL (0.43) MAPTALDH1A1LIPCLIPELPL
Trifluoroacetic Acid SCHEMBL6602042 0.72 LPL (0.46) LIPCLIPELPLABHD16AFAAH
SCHEMBL11248949 0.72 L3MBTL1 (0.76) MAPTKDM4EALDH1A1APAF1POLB
Trifluoroacetic Acid SCHEMBL6606875 0.71 MGLL (0.50) ALDH1A1LIPCLIPELPLABHD16A

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