SCHEMBL10160945

SCHEMBL10160945

NC(=O)c1cc(-c2cnc(Nc3ncc(C(=O)N4CCOCC4)o3)c3nccn23)co1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 13/20 0.67
FYN P06241 1/20 0.39
PTK6 Q13882 3/20 0.36
AURKB Q96GD4 3/20 0.35
AURKA O14965 1/20 0.35
LCK P06239 2/20 0.35
TTK P33981 1/20 0.34
ALK Q9UM73 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
SCHEMBL10160923 0.87 MAPKAPK5 (0.66) MAPKAPK5FYNPTK6AURKBAURKA
SCHEMBL10160941 0.85 MAPKAPK5 (0.65) MAPKAPK5FYNAURKBAURKATTK
SCHEMBL10160892 0.83 MAPKAPK5 (0.65) MAPKAPK5FYNPTK6AURKBAURKA
SCHEMBL10160876 0.82 MAPKAPK5 (0.63) MAPKAPK5FYNALK
SCHEMBL10160918 0.82 MAPKAPK5 (0.65) MAPKAPK5FYNAURKBAURKATTK
SCHEMBL10160944 0.80 MAPKAPK5 (0.51) MAPKAPK5TTK
SCHEMBL14387664 0.80 MAPKAPK5 (0.81) MAPKAPK5FYNAURKBAURKA
SCHEMBL2068760 0.80 MAPKAPK5 (1.00) MAPKAPK5FYNAURKBAURKA
SCHEMBL10160906 0.79 MAPKAPK5 (0.66) MAPKAPK5FYNPTK6
SCHEMBL12941433 0.78 MAPKAPK5 (0.82) MAPKAPK5FYNPTK6AURKBAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006237-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA NV (BE) 2015-04-14 US disclosed
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases ANDREWS MARTIN JAMES INGLIS (BE) 2012-09-13 US disclosed
US-8148369-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA NV (BE) 2012-04-03 US disclosed
US-20090012078-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS, N.V. (BE) 2009-01-08 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 (2 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-20090012078-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885FYN 1037/4885PTK6 3255/4885
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885FYN 1037/4885PTK6 3255/4885

“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.