Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5209515

CCOC(=O)c1c(C(N)=O)sc2c1CCSC2.NCc1cccc(C(=O)N(CC(=O)O)c2ccccc2)c1.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.40
GAA P10253 4/20 0.40
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ADORA1 P30542 2/20 0.33
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
PDE4D Q08499 2/20 0.32
TP53 P04637 1/20 0.32
CNR2 P34972 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRD1 P41143 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
FOLH1 Q04609 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
HTT P42858 1/20 0.30
HPGD P15428 1/20 0.30

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 0.91 PDE4D (0.41) MAPTGAAALDH1A1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5207793 0.89 PDE4D (0.40) MAPTGAAALDH1A1KDM4EADORA1
Trifluoroacetic Acid SCHEMBL5206475 0.88 PTGER4 (0.34) MAPTGAAALDH1A1MEN1KMT2A
Trifluoroacetic Acid SCHEMBL5206983 0.88 MAPT (0.41) MAPTGAAALDH1A1KDM4ESMN1; SMN2
Trifluoroacetic Acid SCHEMBL5208680 0.86 KDM4E (0.36) MAPTGAAALDH1A1KDM4EADORA1
Trifluoroacetic Acid SCHEMBL5210732 0.85 MAPT (0.35) MAPTALDH1A1MEN1KMT2AKDM4E
Trifluoroacetic Acid SCHEMBL5210556 0.84 CXCR2 (0.43) ALDH1A1MEN1KMT2AKDM4ELMNA
Trifluoroacetic Acid SCHEMBL5205966 0.84 PDE4D (0.39) MAPTGAAALDH1A1KDM4EADORA1
Trifluoroacetic Acid SCHEMBL5280152 0.84 ALDH1A1 (0.40) MAPTALDH1A1MEN1KMT2AKDM4E
Trifluoroacetic Acid SCHEMBL5628234 0.84 ALDH1A1 (0.38) MAPTGAAALDH1A1MEN1KMT2A

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