Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5377704

CN(CCc1ccc(C2=NCCN2)cc1)C(=O)CCCN(C)S(=O)(=O)c1ccc(C(F)(F)F)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 14/20 0.52
NISCH Q9Y2I1 3/20 0.44
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL5389031 0.97 BDKRB1 (0.55) BDKRB1NISCHLMNAHTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL5377089 0.96 BDKRB1 (0.53) BDKRB1NISCH
Trifluoroacetic Acid SCHEMBL5378844 0.94 BDKRB1 (0.53) BDKRB1NISCH
Trifluoroacetic Acid SCHEMBL5388344 0.93 BDKRB1 (0.53) BDKRB1NISCH
Trifluoroacetic Acid SCHEMBL5401876 0.93 BDKRB1 (0.53) BDKRB1NISCHLMNAHTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL5388957 0.93 BDKRB1 (0.53) BDKRB1NISCHLMNAHTTSMN1; SMN2
Trifluoroacetic Acid SCHEMBL5390409 0.93 BDKRB1 (0.53) BDKRB1NISCH
Trifluoroacetic Acid SCHEMBL5402615 0.93 BDKRB1 (0.53) BDKRB1NISCHSMN1; SMN2
Trifluoroacetic Acid SCHEMBL5377539 0.93 BDKRB1 (0.53) BDKRB1NISCH
SCHEMBL5382323 0.92 BDKRB1 (0.55) BDKRB1NISCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7291642-B2 Bradykinin-B1 antagonists, process for their preparation and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-11-06 US disclosed
US-20060100219-A1 Novel bradykinin-B1 antagonists, process for their preparation and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-05-11 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-20060100219-A1 Novel bradykinin-B1 antagonists, process for their preparation and their use as medicaments BDKRB1, BDKRB2, MRGPRX1 BDKRB1 1/4885NISCH 380/4885LMNA 1118/4885

“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.