SCHEMBL6748446

SCHEMBL6748446

COC(=O)CNc1ncnc2oc(-c3ccccc3)c(Br)c12

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.60
EGFR P00533 3/20 0.56
AURKA O14965 14/20 0.54
MAP2K1 Q02750 1/20 0.50
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
RAD52 P43351 1/20 0.46
AURKB Q96GD4 3/20 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
SCHEMBL6748457 0.88 CHEK1 (0.79) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL2179113 0.86 AURKA (0.56) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL6748458 0.84 CHEK1 (0.60) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL6748470 0.83 CHEK1 (0.71) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL12409613 0.78 EGFR (0.48) CHEK1EGFRAURKAKMT2AMEN1
SCHEMBL4699137 0.78 CHEK1 (0.55) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL6748496 0.77 AURKA (0.58) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL31061403 0.75 CHEK1 (1.00) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL6748456 0.75 CHEK1 (1.00) CHEK1EGFRAURKAMAP2K1KMT2A
SCHEMBL6748498 0.75 EGFR (0.63) EGFRAURKA

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
US-8183246-B2 Acyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-05-22 US disclosed
US-20090318475-A1 Novel, Acyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2009-12-24 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-20090318475-A1 Novel, Acyclically Substituted Furopyrimidine Derivatives and Use Thereof DPYD, PNPO, TPMT CHEK1 969/4885EGFR 4423/4885AURKA 2909/4885

“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.