SCHEMBL6019212

SCHEMBL6019212

NC(=O)Cn1ccc(Nc2ncnc3ccccc23)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 3/20 0.45
ABL1 P00519 2/20 0.45
DAPK3 O43293 1/20 0.45
MAP4K4 O95819 1/20 0.45
EGFR P00533 1/20 0.45
ERBB2 P04626 1/20 0.45
PIM1 P11309 1/20 0.45
PRKACA P17612 1/20 0.45
LTK P29376 1/20 0.45
MAPK8 P45983 1/20 0.45
CSNK1A1 P48729 1/20 0.45
RPS6KA3 P51812 1/20 0.45
LIMK1 P53667 1/20 0.45
MAP2K1 Q02750 1/20 0.45
ACVR1 Q04771 1/20 0.45
TYRO3 Q06418 1/20 0.45
MAP4K2 Q12851 1/20 0.45
ROCK1 Q13464 1/20 0.45
DYRK1A Q13627 1/20 0.45
MAPK14 Q16539 1/20 0.45

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
SCHEMBL12095668 0.75 LMNA (0.53) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL2642265 0.74 GCK (0.62) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL8976752 0.69 EGFR (0.78) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL4745458 0.69 ADORA3 (0.65) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL31004010 0.69 ADORA3 (0.65) ABCG2ABL1DAPK3MAP4K4EGFR
Acrylamide SCHEMBL4278962 0.66 EGFR (0.70) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL6831353 0.66 EGFR (0.62) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL4751092 0.66 ADORA3 (0.56) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL29236749 0.65 ABCG2 (0.62) ABCG2ABL1DAPK3MAP4K4EGFR
SCHEMBL27960202 0.64 ABCG2 (0.48) ABCG2ABL1DAPK3MAP4K4EGFR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2019832-B1 PROCESS FOR THE PREPARATION OF PYRAZOLYLAMINOQUINAZOLINE DERIVATIVES COMPRISING A PHOSPHATE GROUP ASTRAZENECA AB (SE) 2012-09-12 EP disclosed
US-20060135541-A1 (3-((Quinazolin-4-yl) amino)-1h-pyrazol-1-yl)acetamide derivatives and related compounds as aurora kinase inhibitors for the treatment of proliferative diseases such as cancer ASTRAZENECA AB (SE) 2006-06-22 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-20060135541-A1 (3-((Quinazolin-4-yl) amino)-1h-pyrazol-1-yl)acetamide derivatives and related compounds as aurora kinase inhibitors for the treatment of proliferative diseases such as cancer CDK19, CDK16, AURKC ABCG2 1406/4885ABL1 145/4885DAPK3 1560/4885

“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.