SCHEMBL3259242

SCHEMBL3259242

CCCCC[C@@H](C)Oc1ncnc2oc(-c3ccccc3)c(C3=CCCCC3)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 6/20 0.38
TNK2 Q07912 5/20 0.37
EGFR P00533 4/20 0.37
LCK P06239 3/20 0.37
JAK2 O60674 1/20 0.37
SRC P12931 1/20 0.37
KDR P35968 1/20 0.37
ZAP70 P43403 1/20 0.37
JAK3 P52333 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
UBE2N P61088 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RAD52 P43351 1/20 0.35
CHEK1 O14757 2/20 0.34
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
SCHEMBL3258517 0.97 AURKA (0.38) AURKATNK2EGFRLCKJAK2
SCHEMBL2180431 0.90 CHEK1 (0.38) AURKATNK2EGFRLCKJAK2
SCHEMBL2180134 0.87 CHEK1 (0.39) AURKATNK2EGFRLCKJAK2
SCHEMBL12409654 0.87 CHEK1 (0.39) AURKATNK2EGFRLCKJAK2
SCHEMBL2178584 0.86 AURKA (0.36) AURKATNK2EGFRLCKJAK2
SCHEMBL2178586 0.85 MERTK (0.36) AURKATNK2EGFRLCKJAK2
SCHEMBL2180183 0.83 AURKA (0.37) AURKATNK2EGFRLCKJAK2
SCHEMBL12409631 0.83 AURKA (0.37) AURKATNK2EGFRLCKJAK2
SCHEMBL2180189 0.83 AURKA (0.36) AURKATNK2EGFRLCKJAK2
SCHEMBL4696958 0.80 KDM4E (0.58) AURKATNK2EGFRLCKJAK2

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
EP-2158206-A1 SUBSTITUTED FUROPYRIMIDINES AND USE THEREOF Bayer Schering Pharma Aktiengesellschaft (DE) 2010-03-03 EP disclosed
WO-2008155016-A1 SUBSTITUTED FUROPYRIMIDINES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-24 WO disclosed