SCHEMBL1786511

SCHEMBL1786511

CCc1ccc(-c2c(-c3ccccc3F)oc3ncnc(OC4CCCC(OCC(=O)OC(C)(C)C)C4)c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 2/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
AURKA O14965 3/20 0.32
TNK2 Q07912 3/20 0.31
KDR P35968 1/20 0.31
TEK Q02763 1/20 0.31
FFAR4 Q5NUL3 2/20 0.31
AXL P30530 1/20 0.30
TYRO3 Q06418 1/20 0.30
LCK P06239 1/20 0.30
PTPN1 P18031 1/20 0.30
EGFR P00533 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
SCHEMBL1786037 1.00 MERTK (0.33) MERTKCYP11B1CYP11B2AURKATNK2
SCHEMBL1785444 1.00 MERTK (0.33) MERTKCYP11B1CYP11B2AURKATNK2
SCHEMBL3125008 0.91 MERTK (0.37) MERTKAURKATNK2FFAR4LCK
SCHEMBL1785336 0.91 MERTK (0.37) MERTKAURKATNK2FFAR4LCK
SCHEMBL12607233 0.91 AURKA (0.40) MERTKAURKATNK2LCKEGFR
SCHEMBL12607234 0.91 AURKA (0.40) MERTKAURKATNK2LCKEGFR
SCHEMBL12607248 0.88 AURKA (0.43) MERTKAURKATNK2LCKEGFR
SCHEMBL14467485 0.88 AURKA (0.43) MERTKAURKATNK2LCKEGFR
SCHEMBL14467153 0.88 AURKA (0.43) MERTKAURKATNK2LCKEGFR
SCHEMBL12607257 0.88 AURKA (0.43) MERTKAURKATNK2LCKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8324222-B2 Cyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-04 US disclosed
US-8324222-B2 Cyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-04 US disclosed
US-8324222-B2 Cyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-04 US disclosed
US-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-26 US disclosed
US-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-26 US disclosed
US-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-26 US disclosed
EP-1966218-B1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES BAYER SCHERING PHARMA AG (DE) 2010-07-14 EP disclosed
WO-2008131859-A2 USE OF CYCLICALLY SUBSTITUTED FUROPYRIMIDINE DERIVATIVES FOR TREATING PULMONARY ARTERIAL HYPERTONIA BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-11-06 WO disclosed
WO-2007079861-A1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES BAYER HEALTHCARE AG (DE) 2007-07-19 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-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof DPYD, TK2, TPMT MERTK 974/4885CYP11B1 106/4885CYP11B2 107/4885

“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.