SCHEMBL4996328

SCHEMBL4996328

CC(=O)Nc1cccc(-c2nccc(-c3cc4n(n3)CCNC4=O)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FYN P06241 14/20 0.46
CDC7 O00311 1/20 0.46
PLK1 P53350 1/20 0.45
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 1/20 0.44
PRNP P04156 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL5002412 0.89 MEN1 (0.58) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL4994491 0.86 ABL1 (0.47) CDC7MEN1KMT2AALDH1A1
SCHEMBL5002523 0.86 CDC7 (0.53) FYNCDC7RXFP1
SCHEMBL4997440 0.84 CDC7 (0.49) CDC7KDM4ESMN1; SMN2
SCHEMBL5002453 0.83 CDC7 (0.42) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL5002663 0.83 CDC7 (0.51) FYNCDC7KDM4EMEN1POLB
SCHEMBL4991274 0.83 CDC7 (0.51) FYNCDC7
SCHEMBL4997425 0.83 CDC7 (0.48) FYNCDC7
SCHEMBL5002531 0.83 CDC7 (0.44) CDC7KDM4EMEN1PRNPPOLB
SCHEMBL4994575 0.83 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 FYN 331/4885CDC7 487/4885PLK1 193/4885

“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.