SCHEMBL17145858

SCHEMBL17145858

CC(=O)Oc1c2ccccc2c(OP(=O)(O)O)c2cc(C(C)=O)oc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
KDM4E B2RXH2 6/20 0.41
HTT P42858 5/20 0.41
GAA P10253 3/20 0.41
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PDE4A P27815 2/20 0.37
PDE4B Q07343 2/20 0.37
PDE4C Q08493 2/20 0.37
PDE4D Q08499 2/20 0.37
ALDH1A1 P00352 4/20 0.37
LMNA P02545 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 1/20 0.37
MPI P34949 1/20 0.37
RECQL P46063 2/20 0.36
TSHR P16473 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36

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
SCHEMBL17145859 0.92 PDE4A (0.40) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL12493926 0.88 MAPT (0.48) MAPTKDM4EHTTGAATP53
SCHEMBL17145347 0.84 PDE4A (0.35) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL17145345 0.80 MAPT (0.41) MAPTKDM4EHTTGAATP53
SCHEMBL17145348 0.80 HTT (0.41) MAPTKDM4EHTTGAATP53
SCHEMBL12524657 0.76 KDM4E (0.44) MAPTKDM4EHTTGAATP53
SCHEMBL20089233 0.76 LMNA (0.37) MAPTKDM4EHTTGAATP53
SCHEMBL29488 0.76 LMNA (0.50) MAPTKDM4EHTTGAAHSD17B10
SCHEMBL18123828 0.75 LMNA (0.39) MAPTKDM4EHTTGAATP53
SCHEMBL12494851 0.75 LMNA (0.39) MAPTKDM4EHTTGAATP53

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-9150530-B2 Esters of 4, 9-dihydroxy-naphtho [2, 3-b] furans for disease therapies ZHOUSHAN HAIZHONGZHOU XINSHENG PHARMACEUTICALS CO., LTD. (CN) 2015-10-06 US disclosed