SCHEMBL7608868

SCHEMBL7608868

O=C(Oc1cccc(C(=O)Oc2ccccc2)c1C(=O)Oc1ccccc1)c1cccc(C(=O)Oc2cccc(C(=O)Oc3ccccc3)c2C(=O)Oc2ccccc2)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.56
HPGD P15428 2/20 0.56
ALOX15 P16050 1/20 0.56
MAPT P10636 4/20 0.53
KDM4E B2RXH2 3/20 0.53
TDP1 Q9NUW8 1/20 0.53
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 4/20 0.51
TSHR P16473 1/20 0.51
LMNA P02545 3/20 0.48
NSD2 O96028 1/20 0.45
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CHRM1 P11229 1/20 0.44
TBXA2R P21731 1/20 0.44
SLC6A2 P23975 1/20 0.44
PDE4A P27815 1/20 0.44
ADRA1A P35348 1/20 0.44
KDR P35968 1/20 0.44

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
SCHEMBL5712255 0.87 HSD17B10 (0.71) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL7059810 0.81 HSD17B10 (0.59) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL29444234 0.79 HSD17B10 (0.57) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL7057524 0.79 HSD17B10 (0.57) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL14689568 0.79 HSD17B10 (0.57) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL6144656 0.79 HSD17B10 (0.61) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL4387913 0.78 HSD17B10 (0.76) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL11730266 0.78 MAPT (0.65) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL7536537 0.76 HSD17B10 (0.61) HSD17B10HPGDALOX15MAPTKDM4E
SCHEMBL8369356 0.76 HSD17B10 (0.83) HSD17B10HPGDALOX15MAPTKDM4E

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
EP-1266924-A2 Polycarbonates, polyestercarbonates and polyesters having branched endgroups BAYER AG (DE) 2002-12-18 EP disclosed