SCHEMBL5328637

SCHEMBL5328637

Cc1cc(O)c2c(C)c(Cc3cccc(Cl)c3)c(=O)oc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.62
MAPT P10636 4/20 0.62
ALDH1A1 P00352 4/20 0.62
PTGDR2 Q9Y5Y4 1/20 0.55
RXFP1 Q9HBX9 6/20 0.53
GAA P10253 4/20 0.53
NPSR1 Q6W5P4 2/20 0.53
HSD17B10 Q99714 2/20 0.53
CASP1 P29466 1/20 0.53
CASP7 P55210 1/20 0.53
SAE1 Q9UBE0 1/20 0.48
UBA2 Q9UBT2 1/20 0.48
GLA P06280 1/20 0.46
HSD17B3 P37058 1/20 0.46
ERAP1 Q9NZ08 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
DRD4 P21917 1/20 0.45
CDYL Q9Y232 1/20 0.45
HPGD P15428 3/20 0.45

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
SCHEMBL14317879 0.91 KDM4E (0.76) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5331673 0.87 KDM4E (0.62) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5328894 0.87 KDM4E (0.81) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5324274 0.84 KDM4E (0.60) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5327925 0.81 KDM4E (0.56) KDM4EMAPTALDH1A1PTGDR2HSD17B10
SCHEMBL5326909 0.80 RXFP1 (0.70) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5330767 0.80 KDM4E (0.62) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5330181 0.80 KDM4E (0.62) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL5325401 0.78 KDM4E (0.64) KDM4EMAPTALDH1A1PTGDR2RXFP1
SCHEMBL14317882 0.78 HSD17B3 (0.76) KDM4EMAPTALDH1A1GAANPSR1

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-2007144625-A1 2-OXO-2H-CHROMENE COMPOUNDS ARGENTA DISCOVERY LIMITED (GB) 2007-12-21 WO disclosed