SCHEMBL5026751

SCHEMBL5026751

O=C(Oc1ccccc1)c1cc(O)cc(C(=O)Oc2ccccc2)c1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.61
HPGD P15428 2/20 0.61
ALOX15 P16050 2/20 0.61
NSD2 O96028 1/20 0.58
MAPT P10636 6/20 0.56
LMNA P02545 2/20 0.56
TP53 P04637 1/20 0.56
CYP3A4 P08684 1/20 0.56
ADORA3 P0DMS8 1/20 0.56
CHRM1 P11229 1/20 0.56
TBXA2R P21731 1/20 0.56
SLC6A2 P23975 1/20 0.56
PDE4A P27815 1/20 0.56
ADRA1A P35348 1/20 0.56
KDR P35968 1/20 0.56
SLC6A3 Q01959 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
KDM4E B2RXH2 3/20 0.53
TDP1 Q9NUW8 1/20 0.53

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 0.84 HSD17B10 (0.71) HSD17B10HPGDALOX15NSD2MAPT
SCHEMBL311356 0.83 HPGD (0.59) HSD17B10HPGDALOX15NSD2MAPT
SCHEMBL11865229 0.81 HPGD (0.68) HSD17B10HPGDALOX15NSD2MAPT
SCHEMBL30864246 0.81 HPGD (0.68) HSD17B10HPGDALOX15NSD2MAPT
SCHEMBL11052398 0.81 NSD2 (0.64) HSD17B10HPGDALOX15NSD2MAPT
SCHEMBL347898 0.81 HSD17B10 (0.67) HSD17B10HPGDALOX15NSD2MAPT
SCHEMBL6266475 0.81 CDC25B (0.56) HSD17B10HPGDALOX15NSD2MAPT
Phenol SCHEMBL11753143 0.80 HSD17B10 (0.71) HSD17B10HPGDALOX15NSD2MAPT
Phenol SCHEMBL28249254 0.80 HSD17B10 (0.71) HSD17B10HPGDALOX15NSD2MAPT
Hydroquinone SCHEMBL28293513 0.80 HSD17B10 (0.71) HSD17B10HPGDALOX15NSD2MAPT

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-20080032173-A1 Hydrocarbon type polymer electrolyte, membrane/electrode assembly, and fuel cell power source HITACHI, LTD. (JP) 2008-02-07 US disclosed