Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5206475

CCOC(=O)c1c(C(N)=O)sc2c1CCOC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 7/20 0.34
CNR2 P34972 3/20 0.33
MAPT P10636 3/20 0.33
ADORA1 P30542 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 2/20 0.32
POLB P06746 1/20 0.32
PDE4D Q08499 1/20 0.32
ANO1 Q5XXA6 2/20 0.32
CXCR2 P25025 1/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CFTR P13569 1/20 0.31

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 SCHEMBL5207834 0.90 PDE4D (0.41) CNR2MAPTADORA1LMNAMEN1
Trifluoroacetic Acid SCHEMBL5209515 0.88 MAPT (0.40) CNR2MAPTADORA1LMNAMEN1
Trifluoroacetic Acid SCHEMBL5207793 0.88 PDE4D (0.40) CNR2MAPTADORA1LMNAGAA
Trifluoroacetic Acid SCHEMBL5206983 0.87 MAPT (0.41) MAPTLMNAGAAPOLBTP53
Trifluoroacetic Acid SCHEMBL5208680 0.86 KDM4E (0.36) MAPTADORA1LMNAGAAPDE4D
Trifluoroacetic Acid SCHEMBL5210732 0.84 MAPT (0.35) MAPTLMNAMEN1KMT2APOLB
Trifluoroacetic Acid SCHEMBL5210556 0.84 CXCR2 (0.43) LMNAMEN1KMT2ACXCR2ALDH1A1
Trifluoroacetic Acid SCHEMBL5280152 0.83 ALDH1A1 (0.40) CNR2MAPTLMNAMEN1KMT2A
Trifluoroacetic Acid SCHEMBL5628234 0.83 ALDH1A1 (0.38) CNR2MAPTLMNAMEN1KMT2A
Trifluoroacetic Acid SCHEMBL5205966 0.82 PDE4D (0.39) CNR2MAPTADORA1LMNAGAA

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-1343561-B1 SERINE PROTEASE INHIBITORS TULARIK LTD (GB) 2007-02-28 EP disclosed