Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4363049

O=C(C[C@@H]1CCCN(C(=O)c2ccccc2)C1)Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 8/20 0.46
MAP3K12 Q12852 2/20 0.36
JAK2 O60674 8/20 0.35
JAK1 P23458 8/20 0.35
JAK3 P52333 8/20 0.35
TYK2 P29597 7/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.34
STK4 Q13043 1/20 0.34
STK3 Q13188 1/20 0.34
STK26 Q9P289 1/20 0.34
STK24 Q9Y6E0 1/20 0.34

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 SCHEMBL4363160 1.00 ALK (0.46) ALKMAP3K12JAK2JAK1JAK3
SCHEMBL1074658 0.96 ALK (0.49) ALKMAP3K12JAK2JAK1JAK3
SCHEMBL1074770 0.96 ALK (0.49) ALKMAP3K12JAK2JAK1JAK3
Trifluoroacetic Acid SCHEMBL4363545 0.94 ALK (0.39) ALKMAP3K12JAK2JAK1JAK3
Trifluoroacetic Acid SCHEMBL4363528 0.94 ALK (0.39) ALKMAP3K12JAK2JAK1JAK3
Trifluoroacetic Acid SCHEMBL1075207 0.92 ALK (0.48) ALKJAK2JAK1JAK3TYK2
Trifluoroacetic Acid SCHEMBL4362696 0.92 ALK (0.48) ALKJAK2JAK1JAK3TYK2
Trifluoroacetic Acid SCHEMBL4356053 0.92 ALK (0.47) ALKJAK2JAK1JAK3TYK2
Trifluoroacetic Acid SCHEMBL4358615 0.92 ALK (0.45) ALKJAK2JAK1JAK3TYK2
Trifluoroacetic Acid SCHEMBL4360693 0.92 ALK (0.45) ALKJAK2JAK1JAK3TYK2

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 2 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
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK ALK 3/4885MAP3K12 33/4885JAK2 1/4885

“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.