SCHEMBL4987015

SCHEMBL4987015

CCOC(=O)C(=O)c1ccc(-c2nccc(-c3cc4n(n3)CCNC4=O)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.44
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
MAPKAPK2 P49137 1/20 0.35
ALOX5 P09917 2/20 0.34
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
JMJD6 Q6NYC1 2/20 0.34
NPC1 O15118 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PARP1 P09874 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PRNP P04156 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
SIRT2 Q8IXJ6 2/20 0.33
SIRT1 Q96EB6 2/20 0.33
PIK3C3 Q8NEB9 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
SCHEMBL4991424 0.90 CDC7 (0.46) CDC7PIM1PIM2JMJD6NPC1
SCHEMBL5000180 0.90 CDC7 (0.42) CDC7PIM1PIM2MAPKAPK2JMJD6
SCHEMBL5000506 0.90 CDC7 (0.45) CDC7PIM1PIM2JMJD6NPC1
SCHEMBL4996996 0.84 PIM1 (0.40) CDC7PIM1PIM2JMJD6PARP1
SCHEMBL4995882 0.84 CDC7 (0.49) CDC7PIM1PIM2MAPKAPK2NPC1
SCHEMBL4997289 0.84 CDC7 (0.49) CDC7PIM1PIM2NPC1MEN1
SCHEMBL4996422 0.84 JMJD6 (0.42) CDC7JMJD6
SCHEMBL5002709 0.83 CDC7 (0.48) CDC7PIM1PIM2MAPKAPK2ALOX5
SCHEMBL4991763 0.83 CDC7 (0.52) CDC7PIM1PIM2MAPKAPK2ALOX5
SCHEMBL4996834 0.83 CDC7 (0.54) CDC7PIM1PIM2MAPKAPK2NPC1

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-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS HANAU CATHLEEN E 2008-05-15 US disclosed
US-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS HANAU CATHLEEN E 2008-05-15 US disclosed
US-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS HANAU CATHLEEN E 2008-05-15 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-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS MKNK2, MAPKAPK2, MAP3K2 CDC7 487/4885PIM1 539/4885PIM2 309/4885

“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.