SCHEMBL153201

SCHEMBL153201

O=Cc1ccccc1-n1cc(O[C@@H]2[C@@H](O)[C@@H](O)[C@@H](CO)O[C@H]2O)c2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SLC5A2 P31639 5/20 0.37
SLC5A1 P13866 1/20 0.37
ATM Q13315 1/20 0.35
EPHX2 P34913 1/20 0.34
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA13 Q8N1Q1 2/20 0.33
CA14 Q9ULX7 1/20 0.33
CA6 P23280 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HK1 P19367 1/20 0.33
HK2 P52789 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL153203 0.88 ATM (0.47) SLC5A2SLC5A1ATMEPHX2
SCHEMBL153202 0.88 ATM (0.47) SLC5A2SLC5A1ATMEPHX2
SCHEMBL152728 0.83 SLC28A3 (0.39) SLC5A2SLC5A1ATMEPHX2
SCHEMBL154170 0.83 ATM (0.40) SLC5A2SLC5A1ATMEPHX2HK1
SCHEMBL153287 0.82 HK1 (0.37) SLC5A2SLC5A1CA12CA1CA2
SCHEMBL156208 0.82 NR4A2 (0.43) SLC5A2SLC5A1
SCHEMBL3648218 0.78 SLC5A2 (0.42) SLC5A2SLC5A1ATMEPHX2
SCHEMBL22412720 0.78 SLC5A2 (0.42) SLC5A2SLC5A1ATMEPHX2
SCHEMBL22492210 0.78 ATM (0.40) SLC5A2SLC5A1ATMEPHX2
SCHEMBL14892463 0.78 ATM (0.40) SLC5A2SLC5A1ATMEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
EP-2427431-B1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2013-05-01 EP disclosed
US-20120058503-A1 Novel Indicator Platform BIOSYNTH AG (CH) 2012-03-08 US disclosed
EP-2256103-A1 Novel indicator platform Biosynth AG (CH) 2010-12-01 EP disclosed