SCHEMBL153287

SCHEMBL153287

O=C(c1ccccc1)c1ccccc1-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 16)

geneUniProtsupporting neighboursconfidence
HK1 P19367 2/20 0.37
HK2 P52789 2/20 0.37
CA12 O43570 2/20 0.37
CA9 Q16790 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
LGALS9 O00182 2/20 0.35
LGALS1 P09382 2/20 0.35
LGALS3 P17931 2/20 0.35
LGALS7; LGALS7B P47929 2/20 0.35
RORC P51449 1/20 0.35
SLC5A2 P31639 3/20 0.35
SLC5A1 P13866 2/20 0.35
KMT2A Q03164 1/20 0.34
LGALS8 O00214 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL14058429 0.90 HK1 (0.35) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL154836 0.90 HK1 (0.35) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL151971 0.90 HK1 (0.35) HK1HK2LGALS9LGALS1LGALS3
SCHEMBL3402480 0.89 SLC5A1 (0.41) LGALS9LGALS1LGALS3LGALS7; LGALS7BSLC5A2
SCHEMBL153288 0.89 ATM (0.45) SLC5A2SLC5A1KMT2A
SCHEMBL152728 0.89 SLC28A3 (0.39) LGALS9LGALS1LGALS3LGALS7; LGALS7BSLC5A2
SCHEMBL153289 0.89 ATM (0.45) SLC5A2SLC5A1KMT2A
SCHEMBL27872939 0.89 ATM (0.45) SLC5A2SLC5A1KMT2A
SCHEMBL156208 0.87 NR4A2 (0.43) LGALS9LGALS1LGALS3LGALS7; LGALS7BSLC5A2
SCHEMBL156534 0.87 HK1 (0.38) HK1HK2RORCSLC5A2SLC5A1

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