Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4365375

O=C(CC1CCN(c2ccccn2)C1)Nc1ccc2cc1CCc1cncc(c1)Nc1ncc(Cl)c(n1)N2.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 7/20 0.40
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
TSHR P16473 1/20 0.39
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35
MALT1 Q9UDY8 1/20 0.33
USP30 Q70CQ3 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP8B1 Q9UNU6 1/20 0.33
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
PDK1 Q15118 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 SCHEMBL4365384 0.96 ALDH1A1 (0.41) ALKALDH1A1MAPTTSHRJAK2
SCHEMBL1076357 0.96 ALK (0.43) ALKALDH1A1MAPTTSHRJAK2
Trifluoroacetic Acid SCHEMBL4367404 0.95 ALK (0.40) ALKALDH1A1MAPTTSHRJAK2
SCHEMBL1074574 0.92 ALK (0.44) ALKALDH1A1MAPTTSHRJAK2
Trifluoroacetic Acid SCHEMBL4359306 0.91 ALK (0.40) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL1073397 0.91 ALK (0.42) ALKALDH1A1MAPTTSHRJAK2
SCHEMBL1075180 0.90 ALK (0.43) ALKALDH1A1MAPTTSHRJAK2
Trifluoroacetic Acid SCHEMBL4365346 0.90 ALK (0.43) ALKALDH1A1MAPTTSHRJAK2
Trifluoroacetic Acid SCHEMBL4359492 0.89 JAK2 (0.40) ALKALDH1A1MAPTTSHRJAK2
Trifluoroacetic Acid SCHEMBL4359367 0.89 ALK (0.42) ALKALDH1A1MAPTTSHRJAK2

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 3/4885ALDH1A1 2511/4885MAPT 3239/4885

“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.