SCHEMBL4999913

SCHEMBL4999913

CC(C)Oc1ccc(Br)cc1-c1nccc(-c2cc3n(n2)CCNC3=O)n1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 3/20 0.42
PIM1 P11309 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
HRH4 Q9H3N8 1/20 0.34
LRRK2 Q5S007 2/20 0.34
PDE5A O76074 1/20 0.33
PARP1 P09874 1/20 0.32
PARP10 Q53GL7 1/20 0.32
KMO O15229 1/20 0.31
IRAK4 Q9NWZ3 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
SCHEMBL5000426 0.90 CDC7 (0.44) CDC7PIM1PIM2LRRK2
SCHEMBL14188647 0.89 CDC7 (0.42) CDC7PIM1PIM2PDE5A
SCHEMBL14188646 0.87 CDC7 (0.45) CDC7PIM1PIM2LRRK2PDE5A
SCHEMBL4999662 0.87 CDC7 (0.41) CDC7PIM1PIM2LRRK2
SCHEMBL14188680 0.87 CDC7 (0.41) CDC7PIM1PIM2PDE5A
SCHEMBL14188681 0.86 CDC7 (0.40) CDC7PIM1PIM2PDE5A
SCHEMBL5000407 0.86 CDC7 (0.49) CDC7PIM1PIM2PARP1PARP10
SCHEMBL4991393 0.85 CDC7 (0.43) CDC7PIM1PIM2PARP1PARP10
SCHEMBL4994003 0.83 CDC7 (0.40) CDC7LRRK2
SCHEMBL4996554 0.83 CDC7 (0.40) CDC7PIM1PIM2

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.