Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL14737974

C[C@@H](N)c1nc(CO)co1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 7/20 0.36
DPP7 Q9UHL4 7/20 0.36
DPP8 Q6V1X1 1/20 0.36
S1PR4 O95977 3/20 0.31
S1PR1 P21453 3/20 0.31
S1PR5 Q9H228 2/20 0.31
GRB2 P62993 1/20 0.30
KCNH2 Q12809 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
Trifluoroacetic Acid SCHEMBL27978897 1.00 DPP4 (0.36) DPP4DPP7DPP8S1PR4S1PR1
SCHEMBL14737789 0.86
SCHEMBL14737975 0.78 HDAC1 (0.30)
SCHEMBL7335665 0.76 CCR1 (0.31)
SCHEMBL25387512 0.68 HDAC1 (0.40)
SCHEMBL17653831 0.67 ALDH1A1 (0.38)
SCHEMBL14738957 0.66 MEN1 (0.31)
Trifluoroacetic Acid SCHEMBL16829055 0.65 PKM (0.41) DPP4DPP7
Trifluoroacetic Acid SCHEMBL21048455 0.65 PKM (0.41) DPP4DPP7
SCHEMBL28048195 0.65 GABRA5 (0.34)

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
EP-2763990-B1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN LA ROCHE (CH) 2017-02-22 EP disclosed
EP-2763990-A1 PYRROLOPYRAZINE KINASE INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2014-08-13 EP disclosed
US-8658646-B2 Pyrrolopyrazine kinase inhibitors HOFFMANN-LAROCHE INC. (US) 2014-02-25 US disclosed
WO-2013030138-A1 PYRROLOPYRAZINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2013-03-07 WO disclosed
US-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS HOFFMANN-LA ROCHE INC. 2013-03-07 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-20130059834-A1 PYRROLOPYRAZINE KINASE INHIBITORS SYK, ZAP70, JAK1 DPP4 1636/4885DPP7 1316/4885DPP8 2346/4885

“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.