SCHEMBL2060198

SCHEMBL2060198

CCS(=O)(=O)c1cnc(Nc2ncc(-c3ccc4c(c3)CNC4=O)n3ccnc23)s1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 6/20 0.57
PIK3CD O00329 1/20 0.37
AKT1 P31749 1/20 0.36
POLQ O75417 1/20 0.34
PRKCI P41743 1/20 0.34
TGFBR1 P36897 1/20 0.34
ACVR1 Q04771 1/20 0.34
AURKA O14965 3/20 0.33
AURKB Q96GD4 2/20 0.33
OGA O60502 1/20 0.33
FYN P06241 1/20 0.33
F9 P00740 1/20 0.33
PRF1 P14222 1/20 0.33
TTK P33981 1/20 0.33
MKNK1 Q9BUB5 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
SCHEMBL2060183 0.86 MAPKAPK5 (0.61) MAPKAPK5PIK3CDAKT1POLQPRKCI
SCHEMBL2060196 0.84 MAPKAPK5 (0.39) MAPKAPK5AURKAAURKBFYNTTK
SCHEMBL2060336 0.84 MAPKAPK5 (0.61) MAPKAPK5PIK3CDAKT1POLQPRKCI
SCHEMBL2060514 0.83 MAPKAPK5 (0.63) MAPKAPK5PIK3CDPRKCITGFBR1ACVR1
SCHEMBL2061183 0.81 MAPKAPK5 (0.59) MAPKAPK5PIK3CDAKT1TGFBR1ACVR1
SCHEMBL2060490 0.80 MAPKAPK5 (0.67) MAPKAPK5PIK3CDOGAFYN
SCHEMBL2060525 0.79 MAPKAPK5 (0.61) MAPKAPK5PIK3CDPOLQPRKCITGFBR1
SCHEMBL279679 0.79 MAPKAPK5 (0.65) MAPKAPK5PIK3CDPRKCITGFBR1ACVR1
SCHEMBL2060116 0.79 MAPKAPK5 (0.56) MAPKAPK5PIK3CDAKT1OGAFYN
SCHEMBL2060471 0.78 MAPKAPK5 (0.60) MAPKAPK5PIK3CDPOLQTGFBR1ACVR1

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 10 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-9006237-B2 Fused pyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA NV (BE) 2015-04-14 US disclosed
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-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-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-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
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 3995/4885AKT1 3163/4885
US-20120232075-A1 Fused Pyrazine Compounds Useful for the Treatment of Degenerative and Inflammatory Diseases TNF, LITAF, CNKSR1 MAPKAPK5 307/4885PIK3CD 3995/4885AKT1 3163/4885

“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.