SCHEMBL28263296

SCHEMBL28263296

O=C(O)c1ccc2ccc(C(=O)OCCO)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.46
KDM4E B2RXH2 4/20 0.45
HRH3 Q9Y5N1 3/20 0.45
TDP1 Q9NUW8 1/20 0.44
DRD3 P35462 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
ENPP2 Q13822 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
LMNA P02545 1/20 0.39
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
PARP1 P09874 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL30741570 0.95 KDM4E (0.50) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL7156008 0.95 KDM4E (0.50) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL9127338 0.90 KDM4E (0.46) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL14707366 0.90 HRH3 (0.50) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL13698260 0.89 SLC7A5 (0.45) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL24477105 0.88 SLC7A5 (0.51) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL465188 0.88 HRH3 (0.50) SLC7A5KDM4EHRH3TDP1DRD3
SCHEMBL10824877 0.86 KDM4E (0.50) KDM4ETDP1HTT
SCHEMBL28234326 0.86 KDM4E (0.55) KDM4EHRH3TDP1DRD3ALDH1A1
SCHEMBL9127340 0.85 TDP1 (0.51) KDM4EHRH3TDP1DRD3ALDH1A1

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
CN-105308147-B Flexible shading plate and anti fogging coating composite with anti-fog performance 美国圣戈班性能塑料公司 2019-01-04 CN disclosed