SCHEMBL12409666

SCHEMBL12409666

CC1CC=C(c2c(-c3ccccc3)oc3ncnc(OC(C)CCCCC(=O)O)c23)CC1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.39
AURKA O14965 5/20 0.38
CHEK1 O14757 1/20 0.37
MERTK Q12866 1/20 0.34

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
SCHEMBL2178680 1.00 EGFR (0.39) EGFRAURKACHEK1MERTK
SCHEMBL12409638 0.91 EGFR (0.36) EGFRAURKACHEK1MERTK
SCHEMBL3257701 0.91 EGFR (0.36) EGFRAURKACHEK1MERTK
SCHEMBL12409670 0.91 EGFR (0.40) EGFRAURKACHEK1MERTK
SCHEMBL2178613 0.91 AURKA (0.39) EGFRAURKACHEK1
SCHEMBL2180143 0.91 EGFR (0.40) EGFRAURKACHEK1MERTK
SCHEMBL12409663 0.91 AURKA (0.39) EGFRAURKACHEK1
SCHEMBL12409654 0.87 CHEK1 (0.39) EGFRAURKACHEK1MERTK
SCHEMBL2180134 0.87 CHEK1 (0.39) EGFRAURKACHEK1MERTK
SCHEMBL2180431 0.86 CHEK1 (0.38) EGFRAURKACHEK1MERTK

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-20110166163-A1 SUBSTITUTED FUROPYRIMIDINES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-07-07 US disclosed
US-20110166163-A1 SUBSTITUTED FUROPYRIMIDINES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-07-07 US disclosed
WO-2008155016-A1 SUBSTITUTED FUROPYRIMIDINES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-24 WO 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-20110166163-A1 SUBSTITUTED FUROPYRIMIDINES AND USE THEREOF DPYD, TPMT, TYMP EGFR 4267/4885AURKA 2987/4885CHEK1 800/4885

“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.