Propyl Gallate

Propyl Gallate

SCHEMBL186140

CCCOC(=O)c1cc(O)c(O)c(O)c1.Oc1cccc(O)c1O

nearest known ligand 0.69

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Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.69
SERPINE1 P05121 4/20 0.66
AKR1C4 P17516 1/20 0.65
AKR1C3 P42330 1/20 0.65
AKR1C2 P52895 1/20 0.65
AKR1C1 Q04828 1/20 0.65
TYR P14679 3/20 0.61
L3MBTL1 Q9Y468 1/20 0.59
LMNA P02545 1/20 0.57
ALDH1A1 P00352 1/20 0.56
CHRM1 P11229 1/20 0.56
TSHR P16473 1/20 0.56
SLC6A2 P23975 1/20 0.56
KDR P35968 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
KDM4E B2RXH2 1/20 0.54
POLB P06746 1/20 0.54

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
Propyl Gallate SCHEMBL788397 0.92 ESR1 (0.80) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL22630 0.92 ESR1 (0.80) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL29437579 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL28626398 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL27667868 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL9389174 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL29910229 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL16678445 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL8334443 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2
Propyl Gallate SCHEMBL28272293 0.90 ESR1 (0.77) ESR1SERPINE1AKR1C4AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922730-A Composition comprising a metal oxide and a metal oxide 艾得文瑞士有限公司 2018-04-17 CN disclosed
EP-2401346-A1 BIODIESEL CONTAINING NON-PHENOLIC ADDITIVES AND THEREBY POSSESSING ENHANCED OXIDATIVE STABILITY AND LOW ACID NUMBER Dorivale Holdings Limited (CY) 2012-01-04 EP disclosed
WO-2010097640-A1 BIODIESEL CONTAINING NON-PHENOLIC ADDITIVES AND THEREBY POSSESSING ENHANCED OXIDATIVE STABILITY AND LOW ACID NUMBER DORIVALE HOLDINGS LIMITED (CY) 2010-09-02 WO disclosed