SCHEMBL4748301

SCHEMBL4748301

OC1CCCC(Oc2ncnc3oc(-c4ccccc4)c(Br)c23)C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AURKA O14965 5/20 0.44
EGFR P00533 4/20 0.42
TNK2 Q07912 4/20 0.37
LCK P06239 2/20 0.37
ABL1 P00519 1/20 0.37
LYN P07948 1/20 0.37
BTK Q06187 1/20 0.37
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CHEK1 O14757 3/20 0.34
MAP2K1 Q02750 1/20 0.34
KDM4E B2RXH2 1/20 0.34
UBE2N P61088 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MERTK Q12866 1/20 0.33
FFAR2 O15552 1/20 0.33

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
SCHEMBL1787658 0.82 CHEK1 (0.42) AURKAEGFRTNK2LCKABL1
SCHEMBL12607049 0.81 KDM4E (0.57) AURKATNK2LCKALDH1A1HPGD
SCHEMBL4751375 0.81 KDM4E (0.57) AURKATNK2LCKALDH1A1HPGD
SCHEMBL12607050 0.81 KDM4E (0.57) AURKATNK2LCKALDH1A1HPGD
SCHEMBL12607075 0.79 EGFR (0.37) AURKAEGFRTNK2LCKABL1
SCHEMBL12607076 0.79 EGFR (0.37) AURKAEGFRTNK2LCKABL1
SCHEMBL1785285 0.79 EGFR (0.37) AURKAEGFRTNK2LCKABL1
SCHEMBL12607024 0.78 AURKA (0.36) AURKAEGFRLCKABL1LYN
SCHEMBL13271993 0.78 EGFR (0.44) AURKAEGFRTNK2LCKABL1
SCHEMBL3127835 0.75 AURKA (0.36) AURKAEGFRTNK2LCKALDH1A1

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 6 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-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
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-2008131859-A2 USE OF CYCLICALLY SUBSTITUTED FUROPYRIMIDINE DERIVATIVES FOR TREATING PULMONARY ARTERIAL HYPERTONIA BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-11-06 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 AURKA 3192/4885EGFR 4141/4885TNK2 1169/4885

“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.