SCHEMBL274887

SCHEMBL274887

O=C1N=Cc2cc(-c3cnc(NCC4CCCCC4)c4ncnn34)ccc21

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 2/20 0.40
TTK P33981 2/20 0.39
EGLN2 Q96KS0 4/20 0.36
IKBKB O14920 5/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
ERN1 O75460 3/20 0.34
MKNK1 Q9BUB5 1/20 0.34
CHUK O15111 1/20 0.34
FYN P06241 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
SCHEMBL274498 0.85 MAPKAPK5 (0.42) MAPKAPK5TTKEGLN2MKNK1FYN
SCHEMBL274888 0.83 MAPKAPK5 (0.58) MAPKAPK5TTKEGLN2MKNK1
SCHEMBL274671 0.81 MAPKAPK5 (0.42) MAPKAPK5TTK
SCHEMBL275197 0.79 MAPKAPK5 (0.40) MAPKAPK5TTKEGLN2IKBKBFYN
SCHEMBL2394082 0.69 MAPKAPK5 (0.47) MAPKAPK5TTK
SCHEMBL275076 0.69 FLT3 (0.42) MAPKAPK5TTK
SCHEMBL273764 0.69 MAPKAPK5 (0.61) MAPKAPK5MKNK1
SCHEMBL274499 0.67 MAPKAPK5 (0.62) MAPKAPK5MKNK1
SCHEMBL279913 0.67 MAPKAPK5 (0.57) MAPKAPK5TTK
SCHEMBL279828 0.67 MAPKAPK5 (0.57) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090131446-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflmmatory diseases GALAPAGOS, N.V. (BE) 2009-05-21 US claimed
US-8133895-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA N.V. (BE) 2012-03-13 US disclosed
US-20090131446-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflmmatory diseases GALAPAGOS, N.V. (BE) 2009-05-21 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 (1 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-20090131446-A1 Fused pyrazine compounds useful for the treatment of degenerative and inflmmatory diseases NOD1, TNF, NOD2 MAPKAPK5 1247/4885TTK 4697/4885EGLN2 2621/4885

“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.