SCHEMBL13622651

SCHEMBL13622651

N#Cc1ccc(S(=O)(=O)N2CCC(CC(=O)Nc3ccc4cc3CCc3cccc(c3)Nc3ncc(Cl)c(n3)N4)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 9/20 0.49
CCR6 P51684 6/20 0.39
STK4 Q13043 1/20 0.37
STK3 Q13188 1/20 0.37
STK26 Q9P289 1/20 0.37
STK24 Q9Y6E0 1/20 0.37
JAK2 O60674 5/20 0.36
JAK1 P23458 5/20 0.36
TYK2 P29597 5/20 0.36
JAK3 P52333 5/20 0.36

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 SCHEMBL4361228 0.96 ALK (0.45) ALKCCR6STK4STK3STK26
SCHEMBL4353779 0.93 ALK (0.41) ALKCCR6JAK2JAK1TYK2
SCHEMBL13622647 0.92 ALK (0.51) ALKSTK4STK3STK26STK24
SCHEMBL13669865 0.91 ALK (0.49) ALKSTK4STK3STK26STK24
SCHEMBL13622648 0.90 ALK (0.49) ALKSTK4STK3STK26STK24
SCHEMBL13622667 0.90 ALK (0.49) ALKCCR6
Trifluoroacetic Acid SCHEMBL4360610 0.89 CCR6 (0.39) ALKCCR6JAK2JAK1TYK2
SCHEMBL4359585 0.89 ALK (0.42) ALKCCR6JAK2JAK1TYK2
SCHEMBL1076794 0.89 ALK (0.52) ALKSTK4STK3STK26STK24
SCHEMBL13622657 0.89 ALK (0.48) 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 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
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
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 3/4885CCR6 1352/4885STK4 174/4885

“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.