Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4521875

CS(=O)(=O)c1ccc(-c2ccc3c(c2)COC(C2CCN(C(=O)OCc4ccccc4)CC2)O3)c(NCCN2CCOCC2)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
TRPV4 Q9HBA0 2/20 0.40
CACNA1B Q00975 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA7 P43166 2/20 0.36
MAPT P10636 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ACKR3 P25106 1/20 0.34
APAF1 O14727 1/20 0.33
MITF O75030 1/20 0.33
CASP7 P55210 1/20 0.33
CASP9 P55211 1/20 0.33
CASP6 P55212 1/20 0.33
CASP8 Q14790 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
F13A1 P00488 2/20 0.33
TGM2 P21980 2/20 0.33

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
SCHEMBL4355670 0.96 TRPV4 (0.38) TRPV4CA1CA2CA7MAPT
Trifluoroacetic Acid SCHEMBL4538218 0.90 TGM2 (0.34) CACNA1BGPR119F13A1TGM2TGM1
Trifluoroacetic Acid SCHEMBL4531639 0.89 GPR119 (0.34) GPR119F13A1TGM2TGM1TRPC3
SCHEMBL4355151 0.86 TGM2 (0.36) CA1CA2CA7MAPTF13A1
SCHEMBL4359263 0.85 TGM2 (0.35) GPR119F13A1TGM2TGM1TRPC3
SCHEMBL4539175 0.82 F13A1 (0.43) TRPV4CA1CA2CA7MAPT
Trifluoroacetic Acid SCHEMBL4531900 0.82 GPR119 (0.35) CACNA1BGPR119F13A1TGM2TGM1
SCHEMBL4533901 0.81 SMN1; SMN2 (0.39) MEN1KMT2ANPSR1GPR119F13A1
SCHEMBL4350023 0.81 SMN1; SMN2 (0.40) CA1CA2CA7MEN1KMT2A
SCHEMBL4526460 0.80 SMN1; SMN2 (0.43) MEN1KMT2ANPSR1F13A1TGM2

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-2009150144-A1 NEW GPR119MODULATORS INOVACIA AB (SE) 2009-12-17 WO disclosed