SCHEMBL2060486

SCHEMBL2060486

O=C1N=Cc2cc(-c3cnc(Nc4ncc(CN5CCOCC5)s4)c4nccn34)ccc21

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 14/20 0.49
FYN P06241 1/20 0.40
AURKA O14965 2/20 0.36
AURKB Q96GD4 2/20 0.36
KDR P35968 1/20 0.34
TTK P33981 1/20 0.33

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
SCHEMBL2061179 0.93 MAPKAPK5 (0.42) MAPKAPK5FYNAURKBKDR
SCHEMBL2060111 0.89 MAPKAPK5 (0.40) MAPKAPK5FYNAURKAAURKBTTK
SCHEMBL2060329 0.88 MAPKAPK5 (0.48) MAPKAPK5FYNAURKAAURKB
SCHEMBL2060332 0.86 MAPKAPK5 (0.42) MAPKAPK5FYNTTK
SCHEMBL2060490 0.86 MAPKAPK5 (0.67) MAPKAPK5FYN
SCHEMBL2060358 0.85 MAPKAPK5 (0.48) MAPKAPK5FYNAURKAAURKB
SCHEMBL2060181 0.82 MAPKAPK5 (0.42) MAPKAPK5FYNAURKAAURKBTTK
SCHEMBL2068700 0.80 MAPKAPK5 (0.73) MAPKAPK5FYNAURKAAURKB
SCHEMBL2060380 0.80 MAPKAPK5 (0.40) MAPKAPK5AURKAAURKBKDR
SCHEMBL2060397 0.79 MAPKAPK5 (0.61) MAPKAPK5AURKAAURKBKDR

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 1037/4885AURKA 4395/4885
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885FYN 1037/4885AURKA 4395/4885

“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.