SCHEMBL4993289

SCHEMBL4993289

COC(=O)c1ccccc1-c1nccc(-c2cc3n(n2)CCNC3=O)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.43
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
PARP1 P09874 2/20 0.41
SLC6A3 Q01959 4/20 0.39
SLC6A4 P31645 3/20 0.39
SLC6A2 P23975 1/20 0.39
GRM5 P41594 1/20 0.39
ROCK2 O75116 1/20 0.39
CSF1R P07333 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39
CDK5 Q00535 1/20 0.39
ROCK1 Q13464 1/20 0.39
SLK Q9H2G2 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.39
PRKDC P78527 1/20 0.36
JMJD6 Q6NYC1 1/20 0.35

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
SCHEMBL4997456 0.90 PIM1 (0.41) CDC7PIM1PIM2PARP1JMJD6
SCHEMBL4994749 0.88 CDC7 (0.46) CDC7PIM1PIM2PARP1GRM5
SCHEMBL4991863 0.87 CDC7 (0.46) CDC7PIM1PIM2PARP1GRM5
SCHEMBL4995051 0.87 CDC7 (0.40) CDC7PIM1PIM2KDM4EMEN1
SCHEMBL4991821 0.86 CYP11B1 (0.41) CDC7PIM1PIM2PARP1KDM4E
SCHEMBL4993809 0.86 CDC7 (0.45) CDC7PIM1PIM2PARP1GRM5
SCHEMBL4995748 0.85 CDC7 (0.44) CDC7PIM1PIM2PARP1GRM5
SCHEMBL4995091 0.85 CYP2C8 (0.40) CDC7PIM1PIM2PARP1GRM5
SCHEMBL14188637 0.84 CDC7 (0.43) CDC7PIM1PIM2PARP1GRM5
SCHEMBL4996996 0.84 PIM1 (0.40) CDC7PIM1PIM2PARP1GRM5

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.