SCHEMBL27730414

SCHEMBL27730414

OC[C@H]1O[C@@H](Cc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.55
▸ CA12 O43570 2/20 0.51
▸ CA1 P00915 2/20 0.51
▸ CA2 P00918 2/20 0.51
▸ CA4 P22748 2/20 0.51
▸ CA5A P35218 2/20 0.51
▸ CA7 P43166 2/20 0.51
▸ CA9 Q16790 2/20 0.51
▸ CA3 P07451 1/20 0.51
▸ CA13 Q8N1Q1 1/20 0.51
▸ CA14 Q9ULX7 1/20 0.51
▸ SLC5A2 P31639 5/20 0.49
▸ SLC5A1 P13866 5/20 0.49
▸ PPARG P37231 1/20 0.47
▸ PPARD Q03181 1/20 0.47
▸ PPARA Q07869 1/20 0.47
▸ SLC28A3 Q9HAS3 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 1/20 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
SCHEMBL15820966 0.87 SLC5A2 (0.51) TYRSLC5A2
SCHEMBL15820964 0.87 SLC5A2 (0.51) TYRSLC5A2
SCHEMBL27709951 0.84 SLC5A2 (0.44) TYRSLC5A2SLC5A1
SCHEMBL29197613 0.84 SLC29A1 (0.40) TYRSLC5A2
SCHEMBL27709971 0.84 SLC29A1 (0.40) TYRSLC5A2KDM4EPOLB
SCHEMBL12844835 0.84 SLC5A2 (0.55) SLC5A2SLC5A1
SCHEMBL15981949 0.84 ACHE (0.43) TYRSLC5A2
SCHEMBL8224471 0.84 SLC5A2 (0.55) SLC5A2SLC5A1
SCHEMBL29197612 0.84 SLC29A1 (0.40) TYRSLC5A2
SCHEMBL27730413 0.84 SLC5A2 (0.43) TYRCA12CA1CA2CA4

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-101255178-A C-glycoside and C-glycoside compound containing substituted aromatic rings as well as preparation and use thereofb RADIATION MEDICAL INST PLA ACA (CN) 2008-09-03 — — CN claimed
CN-101255178-A C-glycoside and C-glycoside compound containing substituted aromatic rings as well as preparation and use thereofb RADIATION MEDICAL INST PLA ACA (CN) 2008-09-03 — — CN disclosed
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