SCHEMBL4358516

SCHEMBL4358516

O=C(C[C@@H]1CCCN(C(=O)Nc2ccccc2)C1)Nc1ccc2cc1CCc1cccc(c1)Nc1ncc(Cl)c(n1)N2

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 10/20 0.48
LOXL2 Q9Y4K0 2/20 0.38
JAK2 O60674 9/20 0.37
JAK1 P23458 9/20 0.37
TYK2 P29597 9/20 0.37
JAK3 P52333 9/20 0.37
NAMPT P43490 1/20 0.36
STK4 Q13043 1/20 0.35
STK3 Q13188 1/20 0.35
STK26 Q9P289 1/20 0.35
STK24 Q9Y6E0 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL4360802 1.00 ALK (0.48) ALKLOXL2JAK2JAK1TYK2
Trifluoroacetic Acid SCHEMBL4358615 0.96 ALK (0.45) ALKLOXL2JAK2JAK1TYK2
Trifluoroacetic Acid SCHEMBL4360693 0.96 ALK (0.45) ALKLOXL2JAK2JAK1TYK2
SCHEMBL4358742 0.94 ALK (0.41) ALKLOXL2JAK2JAK1TYK2
SCHEMBL4361448 0.94 ALK (0.41) ALKLOXL2JAK2JAK1TYK2
SCHEMBL4354798 0.93 ALK (0.51) ALKJAK2JAK1TYK2JAK3
SCHEMBL4354684 0.92 ALK (0.50) ALKJAK2JAK1TYK2JAK3
SCHEMBL1074770 0.91 ALK (0.49) ALKJAK2JAK1TYK2JAK3
SCHEMBL1074658 0.91 ALK (0.49) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4365707 0.91 LOXL2 (0.43) ALKLOXL2JAK2JAK1TYK2

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 7 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
WO-2009132202-A2 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-10-29 WO 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 3/4885LOXL2 3613/4885JAK2 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.