SCHEMBL7024344

SCHEMBL7024344

Cc1c(CCC(=O)ON2C(=O)CCC2=O)c(=O)oc2cc(O)ccc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.69
GLA P06280 3/20 0.69
GAA P10253 3/20 0.69
ALDH1A1 P00352 3/20 0.69
HPGD P15428 3/20 0.69
HSD17B10 Q99714 3/20 0.69
CASP1 P29466 2/20 0.69
CASP7 P55210 2/20 0.69
TSHR P16473 1/20 0.65
PSMB8 P28062 2/20 0.64
PSMB5 P28074 1/20 0.64
HSD17B3 P37058 4/20 0.59
PKM P14618 1/20 0.59
MAPT P10636 3/20 0.53
TP53 P04637 3/20 0.52
NPSR1 Q6W5P4 1/20 0.50
ERAP1 Q9NZ08 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.46

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
SCHEMBL593432 0.90 KDM4E (0.57) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL29385493 0.90 KDM4E (0.57) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL8054975 0.88 PSMB8 (0.62) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL30406107 0.82 KDM4E (1.00) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL2554744 0.82 KDM4E (1.00) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL7023152 0.79 KDM4E (1.00) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL8352874 0.79 PSMB8 (0.59) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL2528490 0.78 SRC (0.53) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL29577443 0.78 SRC (0.53) KDM4EGLAGAAALDH1A1HPGD
SCHEMBL18099118 0.78 PSMB8 (1.00) KDM4EHSD17B10PSMB8PSMB5MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538053-B1 Separation and analysis MARCONI OPTICAL COMPONENTS LTD (GB) 2003-01-22 EP disclosed
US-6225043-B1 IMMUNOASSAY IN WHICH ONE OF THE SPECIES IS MASKED AND NOT CAPABLE OF UNDERGOING SPECIFIC BINDING UNLESS REACTED WITH ENZYME WHICH EXPOSES ANTIGENIC LIGAND GEC-MARCONI LIMITED (GB) 2001-05-01 US disclosed
EP-0538053-A1 Separation and analysis GEC-MARCONI LIMITED (GB) 1993-04-21 EP disclosed