SCHEMBL13633185

SCHEMBL13633185

Cc1cnc2nc1Nc1ccc(C(=O)Nc3ccccc3)c(c1)CCc1cccc(c1)N2

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 8/20 0.47
JAK2 O60674 8/20 0.42
NSD2 O96028 1/20 0.36
KCNK3 O14649 1/20 0.36
KCNK9 Q9NPC2 1/20 0.36
JAK1 P23458 7/20 0.36
TYK2 P29597 7/20 0.36
JAK3 P52333 7/20 0.36
KDR P35968 1/20 0.36
HPGD P15428 1/20 0.36
STK26 Q9P289 1/20 0.35
STK24 Q9Y6E0 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL4356998 0.89 ALK (0.57) ALKJAK2JAK1TYK2JAK3
Trifluoroacetic Acid SCHEMBL4358634 0.85 ALK (0.53) ALKJAK2JAK1TYK2JAK3
SCHEMBL4354832 0.80 ALK (0.55) ALKJAK2JAK1TYK2JAK3
SCHEMBL13633117 0.80 ALK (0.48) ALKJAK2JAK1TYK2JAK3
SCHEMBL13632934 0.79 ALK (0.40) ALKJAK2JAK1TYK2JAK3
SCHEMBL13633058 0.79 ALK (0.42) ALKJAK2JAK1TYK2JAK3
SCHEMBL4357238 0.78 ALK (0.54) ALKJAK2JAK1TYK2JAK3
SCHEMBL13633019 0.78 ALK (0.44) ALKJAK2JAK1TYK2JAK3
SCHEMBL13633048 0.78 ALK (0.45) ALKJAK2HPGD
SCHEMBL13634077 0.78 ALK (0.46) ALKJAK2JAK1TYK2JAK3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1/4885NSD2 1290/4885

“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.