Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3484152

NCCCON(CCOc1ccc2sc(S(=O)(=O)NCP(=O)(O)O)cc2c1)OCCCN.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.37
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA9 Q16790 2/20 0.37
CACNA1B Q00975 7/20 0.36
CACNA1H O95180 1/20 0.36
MIF P14174 2/20 0.32
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
TPSAB1 Q15661 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
SCHEMBL3483643 0.93 CA2 (0.35) CA2CA1ITGB3ITGA2BTPSAB1
Trifluoroacetic Acid SCHEMBL3483985 0.90 CA2 (0.39) CA2CA12CA1CA9CACNA1B
Trifluoroacetic Acid SCHEMBL3483752 0.88 CA2 (0.39) CA2CA12CA1CA9CACNA1B
SCHEMBL3483611 0.82 CA2 (0.36) CA2CA1TPSAB1
Trifluoroacetic Acid SCHEMBL3484128 0.82 CA12 (0.36) CA2CA12CA1CA9CACNA1B
SCHEMBL3483924 0.81 CA2 (0.35) CA2CA1ITGB3ITGA2BTPSAB1
SCHEMBL3483644 0.78 KDM4E (0.42) CA2
Trifluoroacetic Acid SCHEMBL3483609 0.77 BCL9 (0.37)
Trifluoroacetic Acid SCHEMBL3483645 0.77 PDGFRB (0.33) CA2CA12CA1CA9CACNA1B
SCHEMBL3483790 0.77 CA2 (0.38) CA2CA1TPSAB1

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
US-20100279983-A1 NOVEL INHIBITORS OF BETA-LACTAMASE METHYLGENE INC. 2010-11-04 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 (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-20100279983-A1 NOVEL INHIBITORS OF BETA-LACTAMASE MGAM, MGAM2, PGLS CA2 440/4885CA12 3327/4885CA1 3102/4885

“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.