SCHEMBL10169140

SCHEMBL10169140

O=C1NCc2cc(-c3cnc(Nc4ccc(N5CCCCC5)nc4)c4nccn34)ccc21

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 12/20 0.71
FYN P06241 1/20 0.41
JAK2 O60674 1/20 0.38
SYK P43405 1/20 0.38
F9 P00740 1/20 0.38
PTK6 Q13882 2/20 0.37
TGFBR1 P36897 1/20 0.37
ACVR1 Q04771 1/20 0.37
MKNK1 Q9BUB5 1/20 0.36
FGFR3 P22607 1/20 0.36
KDR P35968 1/20 0.36

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
SCHEMBL1674043 0.93 MAPKAPK5 (0.83) MAPKAPK5FYNPTK6
SCHEMBL1674235 0.90 MAPKAPK5 (0.65) MAPKAPK5FYNSYKF9PTK6
SCHEMBL10169137 0.90 MAPKAPK5 (0.87) MAPKAPK5FYNTGFBR1ACVR1
SCHEMBL10169141 0.90 MAPKAPK5 (0.70) MAPKAPK5FYNF9TGFBR1ACVR1
SCHEMBL10133621 0.88 MAPKAPK5 (0.55) MAPKAPK5JAK2SYKF9TGFBR1
SCHEMBL12443280 0.85 MAPKAPK5 (0.72) MAPKAPK5JAK2SYKF9TGFBR1
SCHEMBL5574904 0.84 MAPKAPK5 (0.74) MAPKAPK5FYNF9MKNK1
SCHEMBL4395729 0.83 MAPKAPK5 (0.68) MAPKAPK5FYNF9TGFBR1ACVR1
SCHEMBL1674405 0.83 MAPKAPK5 (1.00) MAPKAPK5FYN
SCHEMBL1674349 0.83 MAPKAPK5 (0.70) MAPKAPK5FYNF9MKNK1

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-8178530-B2 Imidazolopyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA NV (BE) 2012-05-15 US disclosed
US-8173656-B2 Imidazolopyrazine compounds useful for the treatment of degenerative and inflammatory diseases JANSSEN PHARMACEUTICA NV (BE) 2012-05-08 US disclosed
US-20110218178-A1 IMIDAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES JANSSEN PHARMACEUTICA NV 2011-09-08 US disclosed
US-20110092497-A1 IMIDAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES JANSSEN PHARMACEUTICA NV 2011-04-21 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 (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-20110218178-A1 IMIDAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES IKZF3, IRAK2, IRAK1 MAPKAPK5 13/4885FYN 1514/4885JAK2 517/4885
US-20110092497-A1 IMIDAZOLOPYRAZINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES IKZF3, IRAK2, IRAK1 MAPKAPK5 13/4885FYN 1514/4885JAK2 517/4885

“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.