Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4356053

O=C(CC1CCN(C(=O)c2ccccc2)CC1)Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 10/20 0.47
TACR2 P21452 2/20 0.38
TACR1 P25103 2/20 0.38
STK4 Q13043 1/20 0.35
STK3 Q13188 1/20 0.35
STK26 Q9P289 1/20 0.35
STK24 Q9Y6E0 1/20 0.35
JAK2 O60674 9/20 0.35
JAK1 P23458 9/20 0.35
JAK3 P52333 9/20 0.35
TYK2 P29597 8/20 0.35
MGLL Q99685 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 SCHEMBL4357947 0.96 ALK (0.46) ALKTACR2TACR1STK4STK3
SCHEMBL1075341 0.96 ALK (0.51) ALKTACR2TACR1STK4STK3
Trifluoroacetic Acid SCHEMBL1076875 0.95 ALK (0.46) ALKTACR2TACR1STK4STK3
Trifluoroacetic Acid SCHEMBL4358410 0.94 ALK (0.45) ALKTACR2TACR1STK4STK3
Trifluoroacetic Acid SCHEMBL4353065 0.94 ALK (0.40) ALKTACR2TACR1JAK2JAK1
Trifluoroacetic Acid SCHEMBL1075419 0.93 ALK (0.45) ALKTACR2TACR1STK4STK3
Trifluoroacetic Acid SCHEMBL1073935 0.93 ALK (0.45) ALKTACR2TACR1STK4STK3
Trifluoroacetic Acid SCHEMBL4363049 0.92 ALK (0.46) ALKSTK4STK3STK26STK24
Trifluoroacetic Acid SCHEMBL4363160 0.92 ALK (0.46) ALKSTK4STK3STK26STK24
Trifluoroacetic Acid SCHEMBL4357857 0.92 ALK (0.50) ALKSTK4STK3STK26STK24

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 3/4885TACR2 3473/4885TACR1 4290/4885

“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.