SCHEMBL10160871

SCHEMBL10160871

NC(=O)c1cc(-c2cnc(Nc3nc(CN4CCOCC4)cs3)c3nccn23)co1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 12/20 0.62
FYN P06241 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
AURKA O14965 2/20 0.36
AURKB Q96GD4 2/20 0.36
GCK P35557 1/20 0.34
TTK P33981 1/20 0.34
ENPP2 Q13822 1/20 0.34
SYK P43405 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
SCHEMBL10160918 0.86 MAPKAPK5 (0.65) MAPKAPK5FYNAURKAAURKBTTK
SCHEMBL10160883 0.86 MAPKAPK5 (0.65) MAPKAPK5FYNSMN1; SMN2AURKAAURKB
SCHEMBL10160876 0.85 MAPKAPK5 (0.63) MAPKAPK5FYNSMN1; SMN2
SCHEMBL10160941 0.82 MAPKAPK5 (0.65) MAPKAPK5FYNAURKAAURKBTTK
SCHEMBL10160875 0.82 MAPKAPK5 (0.48) MAPKAPK5TTK
SCHEMBL10161015 0.80 SMN1; SMN2 (0.43) MAPKAPK5FYNSMN1; SMN2AURKAAURKB
SCHEMBL2060600 0.79 MAPKAPK5 (0.41) MAPKAPK5AURKAAURKB
SCHEMBL14387664 0.79 MAPKAPK5 (0.81) MAPKAPK5FYNAURKAAURKB
SCHEMBL2060329 0.79 MAPKAPK5 (0.48) MAPKAPK5FYNAURKAAURKBSYK
SCHEMBL10160892 0.78 MAPKAPK5 (0.65) MAPKAPK5FYNAURKAAURKB

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 1037/4885SMN1; SMN2 1423/4885
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885FYN 1037/4885SMN1; SMN2 1423/4885

“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.