SCHEMBL7631773

SCHEMBL7631773

C/C=C1/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(O)OCCc1ccc(O)c(O)c1.C/C=C1/[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(O)OCCc1ccc(O)c(O)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.77
IL2 P60568 1/20 0.60
POLB P06746 2/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
PRKCA P17252 3/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
STAT3 P40763 6/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
KDM1A O60341 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.40

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
SCHEMBL124604 1.00 BACE1 (0.77) BACE1IL2POLBMAPTKDM4E
SCHEMBL124603 1.00 BACE1 (0.77) BACE1IL2POLBMAPTKDM4E
Phenol SCHEMBL22345138 0.96 BACE1 (0.71) BACE1IL2POLBMAPTKDM4E
SCHEMBL22400844 0.91 BACE1 (0.64) BACE1IL2POLBMAPTKDM4E
Allicin SCHEMBL5451006 0.90 BACE1 (0.63) BACE1IL2POLBMAPTKDM4E
Honokiol SCHEMBL3837036 0.89 BACE1 (0.62) BACE1IL2POLBMAPTKDM4E
Oleuropein SCHEMBL23133255 0.87 BACE1 (1.00) BACE1IL2POLBMAPTKDM4E
Oleuropein SCHEMBL24452037 0.87 BACE1 (1.00) BACE1IL2POLBMAPTKDM4E
Oleuropein SCHEMBL22220681 0.87 BACE1 (1.00) BACE1IL2POLBMAPTKDM4E
Oleuropein SCHEMBL23559534 0.87 BACE1 (1.00) BACE1IL2POLBMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3661538-A1 COMPOSITIONS AND METHODS FOR AMELIORATING SKIN LAXITY AND BODY CONTOUR Alastin Skincare, Inc. (US) 2020-06-10 EP disclosed
WO-2019028275-A1 COMPOSITIONS AND METHODS FOR AMELIORATING SKIN LAXITY AND BODY CONTOUR ALASTIN Skincare, Inc. (US) 2019-02-07 WO disclosed
US-6455580-B1 NATURALLY OCCURRING SECOIRIDOID FROM PLANTS OF THE FAMILY OLEACEAE OR DERIVATIVES F&S GROUP, INC. 2002-09-24 US disclosed
US-6117844-A Method and composition for antiviral therapy F&S GROUP, INC. (US) 2000-09-12 US disclosed
WO-1996014064-A1 METHOD AND COMPOSITION FOR ANTIVIRAL THERAPY STRECKER, ROBERT, B. (US) 1996-05-17 WO disclosed