SCHEMBL4356253

SCHEMBL4356253

CC(=O)N1CCC(CCOc2ccc3cc2CCc2cncc(c2)Nc2ncc(Cl)c(n2)N3)CC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 9/20 0.56
JAK2 O60674 3/20 0.43
TYK2 P29597 2/20 0.43
JAK3 P52333 2/20 0.43
JAK1 P23458 1/20 0.43
CHEK2 O96017 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
CDK2 P24941 1/20 0.33
FLT3 P36888 1/20 0.33
FNTA P49354 4/20 0.33
FNTB P49356 4/20 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 SCHEMBL1075948 0.96 ALK (0.52) ALKJAK2TYK2JAK3JAK1
SCHEMBL4354533 0.93 ALK (0.56) ALKJAK2TYK2JAK3JAK1
SCHEMBL4359139 0.92 ALK (0.53) ALKJAK2TYK2JAK3JAK1
SCHEMBL13670070 0.92 ALK (0.54) ALKJAK2TYK2JAK3JAK1
SCHEMBL4360727 0.92 ALK (0.54) ALKJAK2TYK2JAK3JAK1
SCHEMBL1072270 0.90 ALK (0.54) ALKJAK2TYK2JAK3JAK1
SCHEMBL4365298 0.89 ALK (0.52) ALKJAK2TYK2JAK3JAK1
Trifluoroacetic Acid SCHEMBL4353188 0.89 ALK (0.49) ALKJAK2TYK2JAK3JAK1
SCHEMBL4363335 0.89 ALK (0.52) ALKJAK2TYK2JAK3JAK1
SCHEMBL4370291 0.89 ALK (0.54) ALKJAK2TYK2JAK3JAK1

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 3/4885JAK2 1/4885TYK2 16/4885

“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.