SCHEMBL4997416

SCHEMBL4997416

COc1ccccc1C(=O)c1cccc(-c2nccc(-c3cc4n(n3)CCNC4=O)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.41
SRC P12931 1/20 0.39
TGFBR1 P36897 1/20 0.39
FYN P06241 3/20 0.38
CFTR P13569 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
EGFR P00533 2/20 0.36
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
ABL1 P00519 1/20 0.36
PDGFRB P09619 1/20 0.36
BCR P11274 1/20 0.36
PDGFRA P16234 1/20 0.36
PRKCA P17252 1/20 0.36
RPS6KA3 P51812 1/20 0.35
RPS6KA2 Q15349 1/20 0.35
TSHR P16473 1/20 0.35
ALOX15 P16050 1/20 0.35

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
SCHEMBL4991381 0.91 CDC7 (0.42) CDC7SRCTGFBR1CFTRPIM1
SCHEMBL4995051 0.87 CDC7 (0.40) CDC7SRCTGFBR1EGFRPIM1
SCHEMBL5002670 0.87 EGFR (0.43) CDC7FYNEGFRABL1BCR
SCHEMBL4996999 0.86 CDC7 (0.42) CDC7FYNMAPKAPK2EGFRPIM1
SCHEMBL4995091 0.83 CYP2C8 (0.40) CDC7EGFRPIM1PIM2ABL1
SCHEMBL5002475 0.82 CDC7 (0.47) CDC7MAPKAPK2PIM1PIM2HCRTR1
SCHEMBL4997440 0.82 CDC7 (0.49) CDC7MAPKAPK2PIM1PIM2ABL1
SCHEMBL4996334 0.82 CFTR (0.44) CDC7CFTR
SCHEMBL4997425 0.81 CDC7 (0.48) CDC7FYNMAPKAPK2PIM1PIM2
SCHEMBL4993909 0.81 CDC7 (0.48) CDC7EGFRPIM1PIM2TSHR

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 487/4885SRC 548/4885TGFBR1 3991/4885

“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.