SCHEMBL4997211

SCHEMBL4997211

CCOC(=O)c1cccc(-c2ccccc2-c2nccc(-c3cc4n(n3)CCNC4=O)n2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JMJD6 Q6NYC1 5/20 0.44
PARP1 P09874 1/20 0.41
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41
PRKDC P78527 1/20 0.40
CDC7 O00311 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
SYK P43405 1/20 0.38
PABPC1 P11940 1/20 0.38
APOBEC3A P31941 1/20 0.38
EIF4H Q15056 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
DYRK3 O43781 1/20 0.38
CCNT1 O60563 1/20 0.38
CCNA2 P20248 1/20 0.38
CDK2 P24941 1/20 0.38
CDK9 P50750 1/20 0.38

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
SCHEMBL4996422 0.90 JMJD6 (0.42) JMJD6CDC7SYK
SCHEMBL4997456 0.87 PIM1 (0.41) JMJD6PARP1PIM1PIM2CDC7
SCHEMBL4991424 0.84 CDC7 (0.46) JMJD6PARP1PIM1PIM2CDC7
SCHEMBL5000180 0.83 CDC7 (0.42) JMJD6PARP1PIM1PIM2CDC7
SCHEMBL5000506 0.83 CDC7 (0.45) JMJD6PARP1PIM1PIM2CDC7
SCHEMBL4994550 0.82 CDC7 (0.52) PARP1PIM1PIM2CDC7
SCHEMBL4996996 0.82 PIM1 (0.40) JMJD6PARP1PIM1PIM2CDC7
SCHEMBL5002764 0.81 CDC7 (0.48) PARP1PIM1PIM2CDC7MEN1
SCHEMBL4993164 0.80 CDC7 (0.45) PIM1PIM2CDC7
SCHEMBL4997568 0.80 MAPT (0.49) MEN1RAB9AKMT2A

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 JMJD6 2625/4885PARP1 2435/4885PIM1 539/4885

“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.