SCHEMBL4997108

SCHEMBL4997108

COc1c(Br)cc(Br)cc1-c1nccc(-c2cc3n(n2)CCNC3=O)n1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.43
PIM1 P11309 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
RPS6KA2 Q15349 2/20 0.31
PARP1 P09874 1/20 0.31
HSD17B10 Q99714 1/20 0.30
LRRK2 Q5S007 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL4999662 0.90 CDC7 (0.41) CDC7PIM1PIM2LRRK2
SCHEMBL4997282 0.89 CDC7 (0.40) CDC7PIM1PIM2
SCHEMBL4996397 0.87 CDC7 (0.48) CDC7PIM1PIM2RPS6KA2PARP1
SCHEMBL4993275 0.85 CDC7 (0.39) CDC7PIM1PIM2PARP1GAA
SCHEMBL5000426 0.85 CDC7 (0.44) CDC7PIM1PIM2LRRK2ALDH1A1
SCHEMBL5002651 0.85 CDC7 (0.46) CDC7PIM1PIM2
SCHEMBL5002452 0.85 CDC7 (0.46) CDC7PIM1PIM2
SCHEMBL4996084 0.85 CDC7 (0.42) CDC7PIM1PIM2RPS6KA2LRRK2
SCHEMBL5000407 0.84 CDC7 (0.49) CDC7PIM1PIM2PARP1ALDH1A1
SCHEMBL4995806 0.84 CDC7 (0.45) CDC7PIM1PIM2RPS6KA2PARP1

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.