SCHEMBL4997342

SCHEMBL4997342

Cc1ccc(-c2nccc(-c3cc4n(n3)CCNC4=O)n2)c(C)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.48
LMNA P02545 1/20 0.45
PIM1 P11309 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
PARP10 Q53GL7 2/20 0.36
PARP11 Q9NR21 1/20 0.36
GRM5 P41594 1/20 0.34
PARP1 P09874 3/20 0.33
RPS6KA3 P51812 1/20 0.33
RPS6KA2 Q15349 2/20 0.33
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
CCNT1 O60563 1/20 0.32
CDK9 P50750 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL4986910 0.91 CDC7 (0.48) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188707 0.90 CDC7 (0.47) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188708 0.90 CDC7 (0.51) CDC7LMNAPIM1PIM2GRM5
SCHEMBL14188527 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188665 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188523 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188687 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188672 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188429 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10
SCHEMBL14188585 0.89 CDC7 (0.46) CDC7LMNAPIM1PIM2PARP10

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 487/4885LMNA 4243/4885PIM1 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.