SCHEMBL4359585

SCHEMBL4359585

N#Cc1cccc(S(=O)(=O)N2CCC(CC(=O)Nc3ccc4cc3CCc3cncc(c3)Nc3ncc(Cl)c(n3)N4)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 7/20 0.42
JAK1 P23458 5/20 0.37
JAK2 O60674 4/20 0.37
TYK2 P29597 1/20 0.37
JAK3 P52333 1/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.35
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
KMT2A Q03164 1/20 0.33
CCR6 P51684 1/20 0.33

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 SCHEMBL4358794 0.96 ALK (0.39) ALKJAK1JAK2TYK2JAK3
SCHEMBL13632948 0.94 POLB (0.38) ALKJAK1JAK2MAPTPOLB
SCHEMBL4353779 0.93 ALK (0.41) ALKJAK1JAK2TYK2JAK3
SCHEMBL1075371 0.91 ALK (0.43) ALKJAK1JAK2TYK2JAK3
SCHEMBL13669961 0.90 ALK (0.42) ALKJAK1JAK2TYK2JAK3
SCHEMBL13622651 0.89 ALK (0.49) ALKJAK1JAK2TYK2JAK3
SCHEMBL1074711 0.89 ALK (0.42) ALKJAK1JAK2TYK2JAK3
Trifluoroacetic Acid SCHEMBL4360610 0.89 CCR6 (0.39) ALKJAK1JAK2TYK2JAK3
SCHEMBL1075377 0.89 ALK (0.42) ALKJAK1JAK2TYK2JAK3
SCHEMBL4363845 0.89 ALK (0.42) ALKJAK1JAK2TYK2JAK3

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 5 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 claimed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US claimed
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

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 3/4885JAK1 2/4885JAK2 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.