SCHEMBL3409928

SCHEMBL3409928

CCn1c(=O)c(Cc2ccc(Cl)cc2)c(C)c2c(OCC(=O)OC(C)(C)C)cc(C)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
HPGD P15428 4/20 0.40
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 3/20 0.40
POLB P06746 2/20 0.40
PKM P14618 1/20 0.39
PLA2G10 O15496 2/20 0.37
PLA2G1B P04054 2/20 0.37
PLA2G2A P14555 2/20 0.37
PLA2G5 P39877 2/20 0.37
PLA2G2E Q9NZK7 2/20 0.37
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
P2RX3 P56373 3/20 0.35
TRPC5 Q9UL62 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PTPN1 P18031 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
SCHEMBL3345462 0.92 PLA2G2A (0.45) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL3348099 0.89 HPGD (0.41) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL3348857 0.89 PLA2G10 (0.46) ALDH1A1HPGDKDM4EHSD17B10PKM
SCHEMBL3344376 0.81 PLA2G2A (0.55) PKMPLA2G10PLA2G1BPLA2G2APLA2G5
SCHEMBL3345040 0.81 PTGDR2 (0.39) ALDH1A1KDM4EHSD17B10PKMPLA2G2A
SCHEMBL3344745 0.80 PTGDR2 (0.48) ALDH1A1HPGDKDM4EHSD17B10PKM
SCHEMBL3344729 0.79 DDB1 (0.41) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL3348700 0.79 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EHSD17B10POLB
SCHEMBL3345066 0.78 TDP1 (0.43) ALDH1A1HPGDKDM4EHSD17B10PKM
SCHEMBL3345108 0.73 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EHSD17B10PKM

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