SCHEMBL10160929

SCHEMBL10160929

NC(=O)c1cc(-c2cnc(Nc3nc(C(=O)N4CC5CC4CO5)co3)c3nccn23)co1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 9/20 0.50
LRRK2 Q5S007 3/20 0.33
CNR2 P34972 2/20 0.32
HTR2C P28335 1/20 0.32
PIK3CD O00329 1/20 0.32
RET P07949 1/20 0.31
KIF5B P33176 1/20 0.31
KDR P35968 1/20 0.31
ETV6 P41212 1/20 0.31
KCNH2 Q12809 1/20 0.31
CCDC6 Q16204 1/20 0.31
GABRA1 P14867 1/20 0.31
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
TTK P33981 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
SCHEMBL10160944 0.89 MAPKAPK5 (0.51) MAPKAPK5LRRK2PIK3CDTTK
SCHEMBL10160878 0.88 MAPKAPK5 (0.48) MAPKAPK5LRRK2CNR2HTR2CPIK3CD
SCHEMBL10160890 0.84 MAPKAPK5 (0.49) MAPKAPK5LRRK2PIK3CD
SCHEMBL10160919 0.84 MAPKAPK5 (0.49) MAPKAPK5JAK2JAK1TTK
SCHEMBL10160896 0.82 MAPKAPK5 (0.50) MAPKAPK5LRRK2HTR2CPIK3CDRET
SCHEMBL10160923 0.80 MAPKAPK5 (0.66) MAPKAPK5
SCHEMBL10160937 0.80 MAPKAPK5 (0.49) MAPKAPK5JAK2JAK1TTK
SCHEMBL10160887 0.77 MAPKAPK5 (0.49) MAPKAPK5JAK2JAK1TTK
SCHEMBL10160875 0.77 MAPKAPK5 (0.48) MAPKAPK5JAK2JAK1TTK
SCHEMBL279482 0.72 MAPKAPK5 (0.62) MAPKAPK5TTK

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 307/4885LRRK2 496/4885CNR2 3036/4885
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885LRRK2 496/4885CNR2 3036/4885

“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.