Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL30005486

CN(c1c(C(N)=O)cccc1C(N)=O)S(C)(=O)=O.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
KMT2A Q03164 1/20 0.39
PTK2 Q05397 1/20 0.37
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
POLB P06746 1/20 0.35
TSHR P16473 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
OPRM1 P35372 3/20 0.34
OPRD1 P41143 3/20 0.34
ALOX15 P16050 1/20 0.34
PARP1 P09874 2/20 0.34
PDK2 Q15119 1/20 0.34
KLK1 P06870 1/20 0.34
KLK5 Q9Y337 1/20 0.34
RPS6KB1 P23443 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
SCHEMBL4210157 0.89 KMT2A (0.46) L3MBTL1KMT2AKEAP1NFE2L2POLB
SCHEMBL4752383 0.86 KMT2A (0.42) L3MBTL1KMT2AKEAP1NFE2L2POLB
Trifluoroacetic Acid SCHEMBL30005064 0.84 KMT2A (0.55) L3MBTL1KMT2APOLBTSHRALOX15
SCHEMBL5186948 0.77 KMT2A (0.47) L3MBTL1KMT2ATSHRALOX15
Trifluoroacetic Acid SCHEMBL1628483 0.77 PTK2 (0.44) PTK2POLBSMN1; SMN2
SCHEMBL4209375 0.74 ALDH1A1 (0.54) L3MBTL1POLBSMN1; SMN2PARP1RPS6KB1
Trifluoroacetic Acid SCHEMBL27999207 0.73 L3MBTL1 (0.44) L3MBTL1KMT2APARP1PDK2KLK1
Trifluoroacetic Acid SCHEMBL1786800 0.73 NPC1 (0.45) L3MBTL1KMT2APOLBTSHR
Trifluoroacetic Acid SCHEMBL5072107 0.73 NPC1 (0.45) L3MBTL1KMT2APOLBTSHR
SCHEMBL28002534 0.71 KMT2A (0.66) L3MBTL1KMT2APOLBTSHRALOX15

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
WO-2022220725-A1 LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS ZAMARATSKI EDOUARD (SE) 2022-10-20 WO disclosed