Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4520838

CCc1nc2c(cnn2CC)c(NC2CCOCC2)c1CNC(=O)CCc1ccc(C(=O)NCc2c(CC)nc3c(cnn3CC)c2NC2CCOCC2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 20/20 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
SCHEMBL4523813 0.95 PDE4B (0.53) PDE4B
SCHEMBL4529760 0.89 PDE4B (0.53) PDE4B
SCHEMBL4523542 0.88 PDE4B (0.58) PDE4B
Trifluoroacetic Acid SCHEMBL4532334 0.88 PDE4B (0.55) PDE4B
SCHEMBL4510472 0.88 PDE4B (0.56) PDE4B
SCHEMBL12181894 0.87 PDE4B (0.53) PDE4B
SCHEMBL1364235 0.87 PDE4B (0.57) PDE4B
SCHEMBL1315436 0.86 PDE4B (0.52) PDE4B
SCHEMBL1561292 0.86 PDE4B (0.52) PDE4B
SCHEMBL1561189 0.86 PDE4B (0.52) PDE4B

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-20090326003-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PDE4 INHIBITORS GLAXO GROUP LIMITED (GB) 2009-12-31 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-20090326003-A1 PYRAZOLO (3, 4-B) PYRIDINE DERIVATIVES AS PDE4 INHIBITORS PDE4A, PDE4B, PDE12 PDE4B 2/4885

“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.