SCHEMBL30968708

SCHEMBL30968708

CC(C)(C)OC(=O)c1c(O)cc(O)cc1C=Cc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.51
MAPT P10636 4/20 0.49
MEN1 O00255 3/20 0.49
CYP3A4 P08684 3/20 0.49
KMT2A Q03164 3/20 0.49
CHRNA7 P36544 1/20 0.49
APP P05067 4/20 0.44
TTR P02766 3/20 0.44
CYP1A1 P04798 3/20 0.44
ALOX5 P09917 3/20 0.44
CYP1B1 Q16678 3/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA3 P07451 2/20 0.44
CA4 P22748 2/20 0.44
CA6 P23280 2/20 0.44
CA5A P35218 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 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
SCHEMBL29271899 0.86 MAPT (0.49) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL28014834 0.80 PTPN1 (0.60) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL28089366 0.80 PTPN1 (0.60) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL26727059 0.78 PTPN1 (0.62) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL13414067 0.77 NR1H2 (0.55) PTPN1MEN1CYP3A4KMT2AALDH1A1
SCHEMBL29018163 0.76 SLC5A1 (0.56) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL29018300 0.75 PTGS1 (0.55) PTPN1CYP3A4CYP1A1CYP1B1CYP1A2
SCHEMBL28670143 0.74 NFKB1 (0.56) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL28670141 0.74 NFKB1 (0.56) PTPN1MAPTMEN1CYP3A4KMT2A
SCHEMBL31596269 0.71 PTPN1 (0.49) PTPN1MAPTMEN1CYP3A4KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118146283-B Resveratrol-glucose conjugate and preparation method and application thereof 四川省农业科学院农产品加工研究所(四川省农业科学院食物与营养健康研究所) 2024-07-16 CN disclosed
CN-118146283-A Resveratrol-glucose conjugate and preparation method and application thereof 四川省农业科学院农产品加工研究所(四川省农业科学院食物与营养健康研究所) 2024-06-07 CN disclosed