Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL25429290

NCC(=O)N1CCn2ccnc2C1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.47
SCD O00767 1/20 0.43
SCD5 Q86SK9 1/20 0.43
RIPK1 Q13546 1/20 0.40
VNN1 O95497 1/20 0.40
NAMPT P43490 1/20 0.40
DPP4 P27487 6/20 0.37
DPP8 Q6V1X1 4/20 0.37
CDK1 P06493 1/20 0.36
MYT1 Q01538 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
DPP9 Q86TI2 1/20 0.35
HRH4 Q9H3N8 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
LIPG Q9Y5X9 1/20 0.34
PIK3CA P42336 2/20 0.34
MTOR P42345 2/20 0.34
KCNH2 Q12809 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
SCHEMBL25937522 0.91 SCD (0.46) P2RX7SCDSCD5RIPK1VNN1
Trifluoroacetic Acid SCHEMBL30557635 0.80 DPP4 (0.54) NAMPTDPP4DPP8CDK1MYT1
SCHEMBL13195585 0.76 SCD (0.46) P2RX7SCDSCD5RIPK1VNN1
SCHEMBL14753264 0.76 SCD (0.46) P2RX7SCDSCD5RIPK1VNN1
SCHEMBL21410419 0.76 SCD (0.53) P2RX7SCDSCD5RIPK1VNN1
SCHEMBL13584658 0.75 SCD (0.44) P2RX7SCDSCD5RIPK1VNN1
SCHEMBL25429882 0.75 SCD (0.46) P2RX7SCDSCD5RIPK1VNN1
Trifluoroacetic Acid SCHEMBL25430229 0.74 NAMPT (0.39) NAMPTDPP4DPP8CDK1MYT1
SCHEMBL31622168 0.74 SCD (0.49) P2RX7SCDSCD5RIPK1VNN1
SCHEMBL2303112 0.73 PARP1 (0.43) P2RX7SCDSCD5RIPK1VNN1

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-2023144793-A1 POL THETA INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-08-03 WO disclosed