SCHEMBL3348099

SCHEMBL3348099

Cc1cc(OCC(=O)OC(C)(C)C)c2c(C)c(Cc3ccc(Cl)cc3)c(=O)n(C)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.41
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 3/20 0.41
POLB P06746 2/20 0.41
PKM P14618 1/20 0.38
TRPC5 Q9UL62 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
PTPN1 P18031 1/20 0.35
CNR2 P34972 1/20 0.34
TP53 P04637 1/20 0.34
P2RX3 P56373 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
SCHEMBL3409928 0.89 ALDH1A1 (0.40) HPGDKDM4EALDH1A1HSD17B10POLB
SCHEMBL3344729 0.88 DDB1 (0.41) HPGDKDM4EALDH1A1HSD17B10POLB
SCHEMBL3345066 0.88 TDP1 (0.43) HPGDKDM4EALDH1A1HSD17B10PKM
SCHEMBL3345462 0.87 PLA2G2A (0.45) HPGDKDM4EALDH1A1HSD17B10POLB
SCHEMBL3344740 0.83 ALDH1A1 (0.39) HPGDKDM4EALDH1A1HSD17B10PKM
SCHEMBL3345108 0.82 ALDH1A1 (0.43) HPGDKDM4EALDH1A1HSD17B10PKM
SCHEMBL3345067 0.81 PPARG (0.42) PKMTRPC5TSHRMAPT
SCHEMBL3348700 0.80 ALDH1A1 (0.41) HPGDKDM4EALDH1A1HSD17B10POLB
SCHEMBL3346109 0.80 ALDH1A1 (0.44) HPGDKDM4EALDH1A1HSD17B10PKM
SCHEMBL3346068 0.80 TDP1 (0.43) HPGDKDM4EALDH1A1HSD17B10PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed