SCHEMBL3358656

SCHEMBL3358656

Cc1c(O)c(=O)[nH]c2ncccc12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 3/20 0.57
PARP1 P09874 1/20 0.57
DAO P14920 2/20 0.56
DDO Q99489 1/20 0.56
FGFR1 P11362 1/20 0.49
FLT1 P17948 1/20 0.49
ALDH1A1 P00352 2/20 0.48
FEN1 P39748 1/20 0.47
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
GRIN1 Q05586 1/20 0.46
GRIN2A Q12879 1/20 0.46
GRIN2B Q13224 1/20 0.46
GRIN2C Q14957 1/20 0.46
GRIN3A Q8TCU5 1/20 0.46
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 1/20 0.44
LOXL3 P58215 1/20 0.42
LOXL2 Q9Y4K0 1/20 0.42
ADORA2A P29274 1/20 0.42

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
SCHEMBL30590365 0.80 AURKA (0.53) AURKAPARP1DAOFGFR1FLT1
SCHEMBL25432963 0.80 AURKA (0.53) AURKAPARP1DAOFGFR1FLT1
SCHEMBL3358664 0.78 AURKA (0.54) AURKAPARP1DAOALDH1A1FEN1
SCHEMBL14224041 0.77 AURKA (0.57) AURKAPARP1DAOFGFR1FLT1
SCHEMBL4518985 0.76 AURKA (0.53) AURKAPARP1DAOFGFR1FLT1
SCHEMBL6101270 0.76 GRIN2D (0.58) AURKAPARP1DAOFGFR1FLT1
SCHEMBL6103937 0.75 FGFR1 (0.57) AURKAPARP1DAOFGFR1FLT1
SCHEMBL7976276 0.75 KDM4E (0.46) AURKAPARP1ALDH1A1FEN1KDM4E
SCHEMBL855363 0.74 KDM4E (0.50) AURKAPARP1ALDH1A1FEN1KDM4E
SCHEMBL30324482 0.74 KDM4E (0.50) AURKAPARP1ALDH1A1FEN1KDM4E

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
WO-2010058314-A1 HYDROXYQUINOLIN-2(1H)-ONES AND DERIVATIVES THEREOF PFIZER INC. (US) 2010-05-27 WO claimed
WO-2010058314-A1 HYDROXYQUINOLIN-2(1H)-ONES AND DERIVATIVES THEREOF PFIZER INC. (US) 2010-05-27 WO disclosed