Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28338349

CS(=O)(=O)NC(=O)c1cc(C2CC2)c(CN2CCC(Oc3cc(Cl)cc(OC(F)(F)F)c3)CC2)cc1F.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 13/20 0.58
▸ SCN7A Q01118 9/20 0.56
▸ SCN5A Q14524 7/20 0.56
▸ SCN1A P35498 1/20 0.51
▸ SCN4A P35499 1/20 0.51
▸ SCN2A Q99250 1/20 0.51
▸ SCN3A Q9NY46 1/20 0.51
▸ SCN8A Q9UQD0 1/20 0.51

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
SCHEMBL17062112 0.97 SCN9A (0.61) SCN9ASCN7ASCN5ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL28336652 0.92 SCN9A (0.65) SCN9ASCN7ASCN5A
Trifluoroacetic Acid SCHEMBL28078857 0.90 SCN7A (0.58) SCN9ASCN7ASCN5ASCN1ASCN4A
SCHEMBL17062137 0.89 SCN9A (0.69) SCN9ASCN7ASCN5A
Trifluoroacetic Acid SCHEMBL16759660 0.88 SCN9A (0.59) SCN9ASCN7ASCN5ASCN1ASCN4A
Trifluoroacetic Acid SCHEMBL16759039 0.87 SCN9A (0.56) SCN9ASCN7ASCN5ASCN1ASCN4A
SCHEMBL18675683 0.86 SCN9A (0.72) SCN9ASCN7ASCN5ASCN1ASCN4A
SCHEMBL21825480 0.86 SCN9A (0.72) SCN9ASCN7ASCN5ASCN1ASCN4A
SCHEMBL17061851 0.86 SCN9A (0.72) SCN9ASCN7ASCN5ASCN1ASCN4A
SCHEMBL17061850 0.86 SCN9A (0.72) SCN9ASCN7ASCN5ASCN1ASCN4A

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
CN-105793238-B Substituted benzamides and methods of use thereof 基因泰克公司 2019-12-24 — — CN disclosed
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