Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3604465

N[C@H]1CCN(C[C@@H]2COc3c(F)cnc4ccc(=O)n2c34)C[C@H]1O.O=C(O)C(F)(F)F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.35
DPP7 Q9UHL4 17/20 0.35
DPP8 Q6V1X1 14/20 0.35
DPP9 Q86TI2 13/20 0.35
KCNH2 Q12809 2/20 0.33
CYP19A1 P11511 1/20 0.33
CYP2D6 P10635 1/20 0.32

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
Hydrochloric Acid SCHEMBL3614515 0.93 KCNH2 (0.36) KCNH2CYP19A1
Trifluoroacetic Acid SCHEMBL3614777 0.89 KCNH2 (0.35) DPP4DPP7DPP8DPP9KCNH2
Trifluoroacetic Acid SCHEMBL3620786 0.89 KCNH2 (0.33) DPP4DPP7DPP8DPP9KCNH2
Trifluoroacetic Acid SCHEMBL3611349 0.86 DPP4 (0.37) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL3604469 0.85 KCNH2 (0.33) DPP4DPP7DPP8DPP9KCNH2
SCHEMBL3618485 0.83 KCNH2 (0.36) KCNH2
SCHEMBL3617297 0.83 KCNH2 (0.36) KCNH2
SCHEMBL3618356 0.82 KCNH2 (0.35) KCNH2
Hydrochloric Acid SCHEMBL3607827 0.81 KCNH2 (0.38) KCNH2
Hydrochloric Acid SCHEMBL3611488 0.81 KCNH2 (0.38) KCNH2

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-20100087424-A1 TRICYCLIC NITROGEN CONTAINING HETEROCYCLES AS ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED 2010-04-08 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-20100087424-A1 TRICYCLIC NITROGEN CONTAINING HETEROCYCLES AS ANTIBACTERIAL AGENTS NRDC, NDC1, NANS DPP4 1065/4885DPP7 1321/4885DPP8 1077/4885

“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.