Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1024081

O=C(O)C(F)(F)F.O=C(O)CC1CCN(c2ncccn2)CC1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.54
CYP2C19 P33261 1/20 0.54
DPP4 P27487 1/20 0.49
DPP8 Q6V1X1 1/20 0.49
DPP9 Q86TI2 1/20 0.49
DPP7 Q9UHL4 1/20 0.49
FFAR4 Q5NUL3 10/20 0.46
ADRA1D P25100 2/20 0.44
ADRA1A P35348 2/20 0.44
ADRA1B P35368 2/20 0.44
GPR119 Q8TDV5 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.43

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
SCHEMBL13622629 0.91 KDM4E (0.63) KDM4ECYP2C19FFAR4ADRA1DADRA1A
Trifluoroacetic Acid SCHEMBL1027044 0.86 FFAR4 (0.44) FFAR4
Trifluoroacetic Acid SCHEMBL1024329 0.84 ALDH1A1 (0.55) KDM4EDPP4DPP8DPP9DPP7
SCHEMBL19134111 0.81 FFAR4 (0.61) FFAR4
SCHEMBL26124974 0.81 CHRM2 (0.50) FFAR4GPR119
SCHEMBL1026507 0.80 KDM4E (0.47) KDM4ECYP2C19DPP4DPP8DPP9
Trifluoroacetic Acid SCHEMBL1024921 0.80 FFAR4 (0.56) DPP4DPP8DPP9DPP7FFAR4
Trifluoroacetic Acid SCHEMBL1025272 0.80 ITGB3 (0.59) DPP4DPP8DPP9DPP7FFAR4
Trifluoroacetic Acid SCHEMBL1023388 0.79 DPP4 (0.53) KDM4EDPP4DPP8DPP9DPP7
Trifluoroacetic Acid SCHEMBL4352885 0.79 FFAR4 (0.46) FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
EP-2274288-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS Incyte Corporation (US) 2011-01-19 EP disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK KDM4E 248/4885CYP2C19 2221/4885DPP4 1423/4885

“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.