SCHEMBL3353611

SCHEMBL3353611

COc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1OC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.70
PTGS1 P23219 1/20 0.63
TYR P14679 3/20 0.62
TDP1 Q9NUW8 1/20 0.61
SNCA P37840 1/20 0.61
MGAM O43451 1/20 0.59
CA12 O43570 1/20 0.59
CA1 P00915 1/20 0.59
CA7 P43166 1/20 0.59
CA9 Q16790 1/20 0.59
CA13 Q8N1Q1 1/20 0.59
SLC5A1 P13866 1/20 0.57
SLC5A2 P31639 1/20 0.57
POLB P06746 2/20 0.56
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
KDM4E B2RXH2 1/20 0.56
GAA P10253 1/20 0.56
RECQL P46063 1/20 0.56
LMNA P02545 1/20 0.56

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
SCHEMBL5597588 1.00 ACHE (0.70) ACHEPTGS1TYRTDP1SNCA
SCHEMBL29360789 1.00 ACHE (0.70) ACHEPTGS1TYRTDP1SNCA
Tachioside SCHEMBL13577078 0.90 POLB (0.63) ACHEPTGS1TYRTDP1CA12
Tachioside SCHEMBL13576891 0.90 POLB (0.63) ACHEPTGS1TYRTDP1CA12
Tachioside SCHEMBL9576060 0.90 POLB (0.63) ACHEPTGS1TYRTDP1CA12
Tachioside SCHEMBL14884668 0.90 POLB (0.63) ACHEPTGS1TYRTDP1CA12
SCHEMBL20056534 0.86 ACHE (0.74) ACHEPTGS1TYRSNCACA12
Koaburaside SCHEMBL30123361 0.86 POLB (0.67) ACHEPTGS1TYRSNCACA12
SCHEMBL9482186 0.85 ACHE (0.56) ACHEPTGS1TYRSNCACA12
SCHEMBL9482204 0.85 ACHE (0.56) ACHEPTGS1TYRSNCACA12

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
JP-2010208958-A PREVENTING OR PROPHYLACTIC AGENT FOR SKIN AGEING CAUSED BY ULTRAVIOLET RADIATION ORIENT HERB KK 2010-09-24 JP disclosed