SCHEMBL18322971

SCHEMBL18322971

OC[C@H]1O[C@@H](Oc2c(O)cccc2C(O)=C(O)c2ccccc2)[C@H](O)[C@@H](O)[C@@H]1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC28A3 Q9HAS3 2/20 0.52
HIF1A Q16665 1/20 0.48
EPHX2 P34913 2/20 0.48
TYR P14679 2/20 0.48
SLC5A1 P13866 2/20 0.46
SLC5A2 P31639 2/20 0.46
ATM Q13315 1/20 0.45
USP2 O75604 3/20 0.43
HKDC1 Q2TB90 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
NPC1 O15118 1/20 0.43
TNNI3 P19429 1/20 0.43
TNNT2 P45379 1/20 0.43
RAB9A P51151 1/20 0.43
TNNC1 P63316 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43

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
SCHEMBL4635305 0.84 SLC28A3 (0.61) SLC28A3HIF1AEPHX2TYRSLC5A1
SCHEMBL29078207 0.82 SLC28A3 (0.64) SLC28A3HIF1AEPHX2TYRSLC5A1
SCHEMBL4636191 0.79 SLC28A3 (0.61) SLC28A3HIF1AEPHX2SLC5A1SLC5A2
Idesin SCHEMBL29441214 0.78 SLC28A3 (0.58) SLC28A3HIF1AEPHX2TYRSLC5A1
Idesin SCHEMBL22807218 0.78 SLC28A3 (0.58) SLC28A3HIF1AEPHX2TYRSLC5A1
SCHEMBL4636160 0.77 SLC28A3 (0.58) SLC28A3HIF1AEPHX2TYRSLC5A1
SCHEMBL4635629 0.76 SLC28A3 (0.57) SLC28A3HIF1AEPHX2TYRSLC5A1
SCHEMBL17559992 0.76 SLC28A3 (0.46) SLC28A3HIF1ATYRSLC5A1SLC5A2
SCHEMBL4635870 0.76 SLC28A3 (0.56) SLC28A3HIF1AEPHX2TYRSLC5A1
SCHEMBL2923796 0.76 SLC28A3 (0.69) SLC28A3HIF1AEPHX2TYRSLC5A1

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
EP-3310361-A1 METHOD FOR TREATING OR PREVENTING DRY EYES Wu, Rong-Tsun (TW) 2018-04-25 EP disclosed
WO-2016201953-A1 METHOD FOR TREATING OR PREVENTING DRY EYES WU RONG-TSUN (CN) 2016-12-22 WO disclosed