Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2224472

N#CC1CCC(N)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 9/20 0.33
DPP8 Q6V1X1 8/20 0.33
KDM1A O60341 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
Trifluoroacetic Acid SCHEMBL28132681 0.90 KDM1A (0.35) DPP4DPP8KDM1A
Trifluoroacetic Acid SCHEMBL14738636 0.89 DPP4 (0.33) DPP4DPP8
Trifluoroacetic Acid SCHEMBL3899456 0.89 DPP4 (0.33) DPP4DPP8
Trifluoroacetic Acid SCHEMBL31630320 0.89 DPP4 (0.33) DPP4DPP8
Trifluoroacetic Acid SCHEMBL28133460 0.83 OAT (0.35) DPP4DPP8
Trifluoroacetic Acid SCHEMBL3154232 0.83 OAT (0.35) DPP4DPP8
Trifluoroacetic Acid SCHEMBL23671375 0.82 DPP4 (0.35) DPP4DPP8
Trifluoroacetic Acid SCHEMBL16818510 0.82 DPP4 (0.35) DPP4DPP8
Trifluoroacetic Acid SCHEMBL16818579 0.82 DPP4 (0.35) DPP4DPP8
Trifluoroacetic Acid SCHEMBL3025153 0.81 OAT (0.36) DPP4DPP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8461328-B2 Tricyclic heterocyclic compounds, compositions and methods of use thereof GENENTECH, INC. (US) 2013-06-11 US disclosed
WO-2013007768-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF AS JAK INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-01-17 WO disclosed
EP-2523957-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF F. Hoffmann-La Roche AG (CH) 2012-11-21 EP disclosed
US-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2011-08-18 US disclosed
WO-2011086053-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2011-07-21 WO 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-20110201593-A1 TRICYCLIC HETEROCYCLIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF CCNY, CCNA1, CCNA2 DPP4 4642/4885DPP8 4561/4885KDM1A 1324/4885

“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.