SCHEMBL151978

SCHEMBL151978

OC[C@H]1O[C@@H](Oc2cn(-c3ccccc3)c3ccccc23)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.54
EPHX2 P34913 1/20 0.52
SLC5A2 P31639 5/20 0.48
SLC5A1 P13866 1/20 0.47
TYR P14679 3/20 0.46
ACHE P22303 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SLC28A3 Q9HAS3 1/20 0.45
PTPN1 P18031 1/20 0.44
CD209 Q9NNX6 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
SCHEMBL154171 1.00 ATM (0.54) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL153498 0.88 SLC5A2 (0.48) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL153499 0.88 SLC5A2 (0.48) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL154170 0.87 ATM (0.40) ATMEPHX2SLC5A2SLC5A1
SCHEMBL17439159 0.83 ATM (0.56) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL19846979 0.83 ATM (0.56) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL29461029 0.83 ATM (0.56) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL6561299 0.83 ATM (0.56) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL19854889 0.83 ATM (0.56) ATMEPHX2SLC5A2SLC5A1TYR
SCHEMBL233859 0.83 ATM (0.56) ATMEPHX2SLC5A2SLC5A1TYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940909-B2 Indicator platform BIOSYNTH AG (CH) 2015-01-27 US disclosed
CN-102459168-B novel indicator platform BIOSINT S.P.A. (CH) 2014-10-01 CN disclosed
EP-2427431-B1 NOVEL INDICATOR PLATFORM BIOSYNTH AG (CH) 2013-05-01 EP disclosed
CN-102459168-A Novel indicator platform BIOSYNTH AG 2012-05-16 CN 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