SCHEMBL6748498

SCHEMBL6748498

COC(=O)CNc1ncnc2oc(-c3ccccc3)cc12

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.63
AURKA O14965 1/20 0.58
GSK3B P49841 7/20 0.57
KDR P35968 2/20 0.57

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
SCHEMBL2178050 0.85 AURKA (0.57) EGFRAURKAGSK3BKDR
SCHEMBL6748457 0.76 CHEK1 (0.79) EGFRAURKA
SCHEMBL6748458 0.75 CHEK1 (0.60) EGFRAURKA
SCHEMBL6748446 0.75 CHEK1 (0.60) EGFRAURKA
SCHEMBL6748496 0.74 AURKA (0.58) EGFRAURKAGSK3BKDR
SCHEMBL757769 0.73 AURKA (1.00) AURKA
SCHEMBL8292220 0.73 GSK3B (1.00) EGFRAURKAGSK3BKDR
SCHEMBL759088 0.72 AURKA (0.83) EGFRAURKAGSK3B
SCHEMBL759303 0.72 AURKA (0.82) EGFRAURKAGSK3BKDR
SCHEMBL6748470 0.72 CHEK1 (0.71) 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 EGFR 4423/4885AURKA 2909/4885GSK3B 2986/4885

“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.