Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3613845

O=C(C=CN1CCCCC1)c1cccc(-c2ccc(F)cc2)n1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 13/20 0.42
CNR2 P34972 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
HSD17B14 Q9BPX1 1/20 0.40
CTSA P10619 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CNR1 P21554 1/20 0.38
ACP1 P24666 1/20 0.38

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 SCHEMBL3622926 0.93 NPSR1 (0.46) SCN9ACNR2NPSR1HSD17B14MEN1
Trifluoroacetic Acid SCHEMBL3617256 0.85 CTSA (0.42) HSD17B14CTSA
Trifluoroacetic Acid SCHEMBL3617476 0.79 IKBKB (0.42) NPSR1MEN1KMT2A
SCHEMBL3608803 0.71 ALDH1A1 (0.41) CNR2MEN1KMT2ACNR1
SCHEMBL1137226 0.70 HSD17B14 (0.57) SCN9AHSD17B14CTSA
SCHEMBL30367705 0.70 HSD17B14 (0.57) SCN9AHSD17B14CTSA
SCHEMBL16026874 0.69 IKBKB (0.46) MEN1KMT2A
SCHEMBL28876906 0.68 SCN9A (0.62) SCN9AHSD17B14
Trifluoroacetic Acid SCHEMBL3620271 0.67 HRH3 (0.49) NPSR1
SCHEMBL3170205 0.67 RAB9A (0.50) NPSR1MEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304438-B2 Heteroarylacrylamides and their use as pharmaceuticals SANOFI (FR) 2012-11-06 US disclosed
US-20100016272-A1 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS SANOFI-AVENTIS (FR) 2010-01-21 US disclosed
EP-2099753-A2 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS Sanofi-Aventis (FR) 2009-09-16 EP disclosed
EP-1939180-A1 Heteroarylacrylamides and their use as pharmaceuticals for the stimulation of the expression of endothelial NO synthase sanofi-aventis (FR) 2008-07-02 EP disclosed
WO-2008074413-A2 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS FOR THE STIMULATION OF THE EXPRESSION OF ENDOTHELIAL NO SYNTHASE SANOFI-AVENTIS (FR) 2008-06-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100016272-A1 HETEROARYLACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS NOS3, PTGIS, NOS1 SCN9A 3082/4885CNR2 686/4885NPSR1 554/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.