Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5320030

COc1cc(CN(CCN)C(=O)Nc2ccccc2)ccc1OCc1ccccc1F.O=C(O)C(F)(F)F

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.56
TSHR P16473 5/20 0.50
RAB9A P51151 2/20 0.45
KMT2A Q03164 2/20 0.45
HTT P42858 1/20 0.45
GAA P10253 3/20 0.45
MAPT P10636 2/20 0.45
FFAR4 Q5NUL3 1/20 0.45
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTR5A P47898 1/20 0.42
KCNH2 Q12809 1/20 0.42
SCN3A Q9NY46 1/20 0.42
NOX1 Q9Y5S8 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL5315896 0.96 TRPM8 (0.60) TRPM8TSHRRAB9AKMT2AHTT
Trifluoroacetic Acid SCHEMBL5315884 0.93 TRPM8 (0.53) TRPM8TSHRRAB9AKMT2AGAA
SCHEMBL5315853 0.88 TRPM8 (0.57) TRPM8TSHRRAB9AKMT2AGAA
Trifluoroacetic Acid SCHEMBL5111885 0.88 TRPM8 (0.52) TRPM8TSHRRAB9AKMT2AHTT
SCHEMBL5318568 0.86 TSHR (0.51) TRPM8TSHRRAB9AKMT2AHTT
SCHEMBL14463942 0.86 TRPM8 (0.73) TRPM8TSHRRAB9AKMT2AMEN1
Trifluoroacetic Acid SCHEMBL5114908 0.84 TRPM8 (0.59) TRPM8TSHRRAB9AKMT2AHTT
SCHEMBL5321993 0.83 TRPM8 (0.67) TRPM8TSHRRAB9AKMT2AMEN1
SCHEMBL14078195 0.83 TRPM8 (0.56) TRPM8TSHRRAB9AKMT2AHTT
SCHEMBL14464512 0.82 TRPM8 (0.52) TRPM8TSHRRAB9AKMT2AGAA

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-2007080109-A1 SUBSTITUDED BENZYLOXY-PHENYLMETHYLUREA DERIVATIVES BAYER HEALTHCARE AG (DE) 2007-07-19 WO disclosed