Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL6601368

COc1nn(-c2ccc(NCc3cc4ccccc4nc3Cl)cc2)c(=O)o1.O=C(O)C(F)(F)F

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.43
FAAH O00519 4/20 0.43
LPL P06858 1/20 0.43
LIPC P11150 1/20 0.43
LIPE Q05469 1/20 0.43
ABHD16A O95870 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
GPR6 P46095 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 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 SCHEMBL6603532 0.93 MGLL (0.46) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6599708 0.82 LPL (0.46) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6601589 0.78 ABHD16A (0.47) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6601568 0.74 LPL (0.47) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6602539 0.73 MAPT (0.45) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6600841 0.73 MGLL (0.50) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6602042 0.71 LPL (0.46) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6601748 0.71 FAAH (0.44) MGLLFAAHLPLLIPCLIPE
SCHEMBL6601929 0.71 ABHD16A (0.50) MGLLFAAHLPLLIPCLIPE
Trifluoroacetic Acid SCHEMBL6599840 0.71 MGLL (0.48) MGLLFAAHLPLLIPCLIPE

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