SCHEMBL4530791

SCHEMBL4530791

CCc1ccc(-c2c(-c3ccccc3F)oc3ncnc(OC[C@@H](C)COC(C)OC(C)=O)c23)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 3/20 0.34
AURKA O14965 11/20 0.33
EGFR P00533 2/20 0.32
AURKB Q96GD4 2/20 0.32
CHEK1 O14757 1/20 0.32
KDR P35968 2/20 0.31
TEK Q02763 2/20 0.31
ALOX5 P09917 1/20 0.30
AXL P30530 1/20 0.30
TYRO3 Q06418 1/20 0.30

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
SCHEMBL4530792 0.87 AURKA (0.34) MERTKAURKAEGFRAURKBCHEK1
SCHEMBL4533384 0.86 MERTK (0.37) MERTKAURKAEGFRAURKBCHEK1
SCHEMBL6751225 0.84 AURKA (0.41) MERTKAURKAEGFRAURKBCHEK1
SCHEMBL4527789 0.82 AURKA (0.37) MERTKAURKAEGFRAURKBCHEK1
SCHEMBL4530700 0.79 AURKA (0.34) MERTKAURKAEGFRAURKBCHEK1
SCHEMBL4521045 0.77 KDM4E (0.44) MERTKAURKAEGFRAURKBCHEK1
SCHEMBL14923147 0.76 AURKA (0.34) MERTKAURKAEGFRAURKBKDR
SCHEMBL4519939 0.76 AURKA (0.41) AURKACHEK1KDRTEK
SCHEMBL14923143 0.76 AURKA (0.41) AURKACHEK1KDRTEK
SCHEMBL4519987 0.76 CHEK1 (0.46) MERTKAURKAEGFRAURKBCHEK1

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 MERTK 1999/4885AURKA 2909/4885EGFR 4423/4885

“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.