SCHEMBL10160893

SCHEMBL10160893

O=C1NCc2cc(-c3cnc(Nc4nc(CN5CC6CC5CO6)co4)c4nccn34)ccc21

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 6/20 0.51
PIK3CD O00329 1/20 0.33
BRAF P15056 3/20 0.32
SYK P43405 1/20 0.32
METTL3 Q86U44 1/20 0.31
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
LRRK2 Q5S007 1/20 0.31
WNT1 P04628 1/20 0.30
GSK3B P49841 1/20 0.30
DYRK1A Q13627 1/20 0.30
PDE1B Q01064 1/20 0.30

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
SCHEMBL10160901 0.88 MAPKAPK5 (0.52) MAPKAPK5PIK3CDBRAFSYKWNT1
SCHEMBL10160823 0.87 MAPKAPK5 (0.50) MAPKAPK5PIK3CDBRAFSYKMETTL3
SCHEMBL10160851 0.85 MAPKAPK5 (0.52) MAPKAPK5PIK3CDBRAFSYKWNT1
SCHEMBL10160896 0.84 MAPKAPK5 (0.50) MAPKAPK5PIK3CDSYKMKNK1LRRK2
SCHEMBL10160891 0.82 MAPKAPK5 (0.65) MAPKAPK5PIK3CD
SCHEMBL10160919 0.81 MAPKAPK5 (0.49) MAPKAPK5METTL3WNT1GSK3BDYRK1A
SCHEMBL10160905 0.80 MAPKAPK5 (0.51) MAPKAPK5SYKMKNK1MKNK2LRRK2
SCHEMBL10160830 0.76 MAPKAPK5 (0.49) MAPKAPK5PIK3CDSYKMKNK1LRRK2
SCHEMBL10160859 0.75 MAPKAPK5 (0.51) MAPKAPK5SYKMKNK1LRRK2GSK3B
SCHEMBL10160894 0.73 MAPKAPK5 (0.65) MAPKAPK5PIK3CD

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 307/4885PIK3CD 3995/4885BRAF 475/4885
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885PIK3CD 3995/4885BRAF 475/4885

“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.