SCHEMBL4991993

SCHEMBL4991993

CC(=O)Nc1c(Br)cc(-c2nccc(-c3cc4n(n3)CCNC4=O)n2)cc1Br

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 2/20 0.46
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
PRNP P04156 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
PIM1 P11309 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
PIK3C3 Q8NEB9 4/20 0.35
CYP1A2 P05177 1/20 0.34
ALOX5 P09917 2/20 0.34
ALOX5AP P20292 2/20 0.34
FEN1 P39748 2/20 0.34
BUB1 O43683 2/20 0.33
MAPKAPK2 P49137 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
RPS6KA2 Q15349 2/20 0.33

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
SCHEMBL4994575 0.89 CDC7 (0.44) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL5000387 0.86 CDC7 (0.51) CDC7GAAPIM1PIM2PIK3C3
SCHEMBL5002623 0.86 CDC7 (0.51) CDC7MEN1GAAKMT2APIM1
SCHEMBL5002412 0.85 MEN1 (0.58) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL4994188 0.83 CDC7 (0.51) CDC7GAAPIM1PIM2MAPKAPK2
SCHEMBL4996397 0.83 CDC7 (0.48) CDC7PIM1PIM2CYP1A2MAPKAPK2
SCHEMBL4996328 0.82 FYN (0.46) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL4999667 0.82 CDC7 (0.54) CDC7MEN1GAAKMT2APIM1
SCHEMBL14188476 0.82 CDC7 (0.49) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL5002531 0.81 CDC7 (0.44) CDC7KDM4EMEN1PRNPPOLB

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 487/4885KDM4E 2647/4885MEN1 2627/4885

“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.