SCHEMBL4366970

SCHEMBL4366970

COc1cccc(S(=O)(=O)Nc2ccc3cc2CCc2cccc(c2)Nc2ncc(Cl)c(n2)N3)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 11/20 0.54
KEAP1 Q14145 2/20 0.42
NFE2L2 Q16236 2/20 0.42
GLO1 Q04760 1/20 0.42
SLC40A1 Q9NP59 1/20 0.42
STK4 Q13043 1/20 0.41
STK3 Q13188 1/20 0.41
STK26 Q9P289 1/20 0.41
STK24 Q9Y6E0 1/20 0.41
JAK2 O60674 9/20 0.41
JAK1 P23458 9/20 0.41
JAK3 P52333 9/20 0.41
TYK2 P29597 8/20 0.41

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
SCHEMBL4358968 0.93 ALK (0.55) ALKSTK4STK3STK26STK24
SCHEMBL4354484 0.90 ALK (0.57) ALKSTK4STK3STK26STK24
SCHEMBL4356410 0.89 ALK (0.56) ALKSLC40A1STK4STK3STK26
SCHEMBL4359039 0.89 ALK (0.57) ALKSTK4STK3STK26STK24
SCHEMBL4356599 0.87 ALK (0.57) ALKSTK4STK3STK26STK24
SCHEMBL4353632 0.87 ALK (0.56) ALKSTK4STK3STK26STK24
SCHEMBL4363117 0.86 ALK (0.55) ALKGLO1SLC40A1STK4STK3
SCHEMBL1075584 0.85 ALK (0.52) ALKSLC40A1STK4STK3STK26
SCHEMBL1074479 0.85 ALK (0.52) ALKSTK4STK3STK26STK24
SCHEMBL4371237 0.84 ALK (0.62) 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 6 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
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 3/4885KEAP1 1266/4885NFE2L2 3024/4885

“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.