Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL29666103

Cn1nccc1S(=O)(=O)Nc1c(F)cc(C#Cc2cncc(F)c2)cc1F.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 3/20 0.37
NLRP3 Q96P20 1/20 0.35
GRM5 P41594 6/20 0.34
RAB9A P51151 1/20 0.33
EGLN1 Q9GZT9 1/20 0.32
EGLN3 Q9H6Z9 1/20 0.32
OXTR P30559 1/20 0.31
AVPR1A P37288 1/20 0.31
NR3C2 P08235 1/20 0.30
KDR P35968 1/20 0.30
KAT6A Q92794 1/20 0.30

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 SCHEMBL22980521 1.00 PIK3CA (0.37) PIK3CANLRP3GRM5RAB9AEGLN1
SCHEMBL24467941 0.92 PIK3CA (0.41) PIK3CANLRP3GRM5RAB9A
SCHEMBL29434787 0.92 PIK3CA (0.41) PIK3CANLRP3GRM5RAB9A
Trifluoroacetic Acid SCHEMBL22980338 0.81 SLC40A1 (0.39) PIK3CAEGLN1EGLN3NR3C2KDR
SCHEMBL22982184 0.79 GRM4 (0.41) PIK3CANLRP3RAB9A
SCHEMBL22980522 0.76 GRM5 (0.33) PIK3CAGRM5
Trifluoroacetic Acid SCHEMBL22980528 0.75 ACLY (0.34) PIK3CAEGLN1EGLN3
SCHEMBL29434888 0.71 SLC40A1 (0.44) PIK3CAGRM5KDRKAT6A
SCHEMBL22980265 0.71 SLC40A1 (0.44) PIK3CAGRM5KDRKAT6A
Trifluoroacetic Acid SCHEMBL28718812 0.69 HSD11B1 (0.39) GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4013495-B1 ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS HOFFMANN LA ROCHE (CH) 2023-09-27 EP claimed
EP-4013495-A1 ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS F. Hoffmann-La Roche AG (CH) 2022-06-22 EP claimed
US-12065399-B2 Arylsulfonamide derivatives HOFFMANN-LA ROCHE INC. (US) 2024-08-20 US disclosed
EP-4013495-B1 ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS HOFFMANN LA ROCHE (CH) 2023-09-27 EP disclosed
EP-4013495-A1 ARYLSULFONAMIDE DERIVATIVES AS MGLUR4 NEGATIVE ALLOSTERIC MODULATORS F. Hoffmann-La Roche AG (CH) 2022-06-22 EP disclosed
US-20220169599-A1 ARYLSULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2022-06-02 US 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 (2 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-20220169599-A1 ARYLSULFONAMIDE DERIVATIVES ARSA, SULT1E1, STS PIK3CA 1815/4885NLRP3 2573/4885GRM5 4194/4885
US-12065399-B2 Arylsulfonamide derivatives ARSA, SULT1E1, STS PIK3CA 1815/4885NLRP3 2573/4885GRM5 4194/4885

“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.