SCHEMBL5327558

SCHEMBL5327558

CC(=O)Oc1cc(C)cc2oc(=O)c(Cc3ccc(Cl)cc3)c(C)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.58
KDM4E B2RXH2 8/20 0.57
MAPT P10636 3/20 0.57
SAE1 Q9UBE0 1/20 0.57
UBA2 Q9UBT2 1/20 0.57
PTGDR2 Q9Y5Y4 1/20 0.53
PKM P14618 1/20 0.52
CNR2 P34972 1/20 0.51
ALDH1A1 P00352 7/20 0.48
HSD17B10 Q99714 6/20 0.48
HPGD P15428 4/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
USP2 O75604 1/20 0.48
MAPK1 P28482 1/20 0.48
POLB P06746 1/20 0.47
MAP2K1 Q02750 1/20 0.47
BRD4 O60885 1/20 0.45
LMNA P02545 2/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL5329822 0.86 PKM (0.61) TP53KDM4EMAPTSAE1UBA2
SCHEMBL5331673 0.82 KDM4E (0.62) TP53KDM4EMAPTSAE1UBA2
SCHEMBL5326933 0.80 KDM4E (0.50) TP53KDM4EMAPTSAE1UBA2
SCHEMBL5327554 0.80 PTGDR2 (0.81) TP53KDM4EMAPTSAE1UBA2
SCHEMBL5328927 0.80 PTGDR2 (0.64) TP53KDM4EMAPTSAE1UBA2
SCHEMBL5325062 0.78 KDM4E (0.59) KDM4EMAPTSAE1UBA2PTGDR2
SCHEMBL27826430 0.78 PLA2G2A (0.42) TP53KDM4EMAPTSAE1UBA2
SCHEMBL5329826 0.76 KDM4E (0.68) KDM4EMAPTSAE1UBA2PTGDR2
SCHEMBL6583766 0.75 KDM4E (0.77) TP53KDM4EMAPTPTGDR2ALDH1A1
SCHEMBL5334050 0.75 BRD4 (0.61) KDM4EMAPTSAE1UBA2PTGDR2

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