SCHEMBL4359660

SCHEMBL4359660

Cc1cc(C(=O)N2CCC(CCC(=O)Nc3ccc4cc3CCc3cccc(c3)Nc3ncc(Cl)c(n3)N4)CC2)no1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 11/20 0.48
MAPT P10636 1/20 0.36
JAK2 O60674 8/20 0.35
JAK1 P23458 8/20 0.35
JAK3 P52333 8/20 0.35
TYK2 P29597 7/20 0.35
KMT2A Q03164 1/20 0.35
STK4 Q13043 1/20 0.34
STK3 Q13188 1/20 0.34
STK26 Q9P289 1/20 0.34
STK24 Q9Y6E0 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 SCHEMBL4365262 0.96 ALK (0.45) ALKMAPTJAK2JAK1JAK3
SCHEMBL4356523 0.94 ALK (0.40) ALKMAPTJAK2JAK1JAK3
SCHEMBL4359814 0.94 ALK (0.49) ALKJAK2JAK1JAK3TYK2
Trifluoroacetic Acid SCHEMBL4358304 0.91 ALK (0.45) ALKJAK2JAK1JAK3TYK2
Trifluoroacetic Acid SCHEMBL4363186 0.90 ALK (0.37) ALKMAPTJAK2JAK1JAK3
SCHEMBL4360766 0.89 ALK (0.51) ALKJAK2JAK1JAK3TYK2
SCHEMBL4361370 0.88 ALK (0.50) ALKJAK2JAK1JAK3TYK2
SCHEMBL13633016 0.88 ALDH1A1 (0.34) ALKMAPTJAK2JAK1JAK3
SCHEMBL4358636 0.88 ALK (0.49) ALKJAK2JAK1JAK3TYK2
SCHEMBL4361157 0.88 ALK (0.49) ALKJAK2JAK1JAK3TYK2

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 3/4885MAPT 3239/4885JAK2 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.