SCHEMBL4259982

SCHEMBL4259982

CCc1c(OCC(=O)OC)ccc2oc(-c3ccccc3)c(C(=O)O)c12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.47
ALDH1A1 P00352 6/20 0.47
HPGD P15428 5/20 0.47
MAPK1 P28482 1/20 0.47
RECQL P46063 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 1/20 0.44
CA9 Q16790 1/20 0.43
PLA2G1B P04054 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.40
ANO1 Q5XXA6 1/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL20241100 0.77 GAA (0.55) KDM4EALDH1A1HPGDMAPK1RECQL
SCHEMBL3535665 0.72 KDM4E (0.50) KDM4EALDH1A1HPGDMAPK1RECQL
SCHEMBL16291562 0.69 EDNRA (0.55) KDM4EALDH1A1HPGDMAPK1RECQL
SCHEMBL4259979 0.69 KDM4E (0.82) KDM4EALDH1A1HPGDMAPK1RECQL
SCHEMBL2402149 0.68 ANO1 (0.44) KDM4EALDH1A1HPGDMAPK1RECQL
SCHEMBL10372054 0.66 ALDH1A1 (0.67) KDM4EALDH1A1RECQLMEN1KMT2A
SCHEMBL14327977 0.65 L3MBTL1 (0.64) KDM4EALDH1A1MAPK1MEN1KMT2A
SCHEMBL10506317 0.65 SMN1; SMN2 (0.60) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL3536870 0.65 ALDH1A1 (0.63) KDM4EALDH1A1HPGDHSD17B10MEN1
SCHEMBL10193137 0.65 PPARD (0.59) KDM4EALDH1A1HPGDHSD17B10MEN1

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
US-7488721-B2 Real time methylumbelliferone-based assay MCMASTER UNIVERSITY (CA) 2009-02-10 US disclosed