SCHEMBL4608468

SCHEMBL4608468

OC[C@H]1O[C@](O)(c2cccc3ccccc23)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PYGL P06737 2/20 0.40
CD209 Q9NNX6 1/20 0.39
LGALS9 O00182 1/20 0.36
LGALS8 O00214 1/20 0.36
LGALS1 P09382 1/20 0.36
LGALS3 P17931 1/20 0.36
LGALS7; LGALS7B P47929 1/20 0.36

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
SCHEMBL4608471 1.00 PYGL (0.40) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL6839290 1.00 PYGL (0.40) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL6839294 1.00 PYGL (0.40) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL7082465 0.85 LGALS8 (0.38) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL7088201 0.83 LGALS1 (0.36) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL4511976 0.82 PYGL (0.37) PYGL
SCHEMBL4511983 0.82 PYGL (0.37) PYGL
SCHEMBL7082196 0.81 CD209 (0.35) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL7082131 0.80 LGALS8 (0.34) PYGLCD209LGALS9LGALS8LGALS1
SCHEMBL7082083 0.80 LGALS1 (0.34) PYGLCD209LGALS9LGALS8LGALS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102977160-A Beta-galactosidase chromogenic substrate preparation method using 4-nityl-1-naphthol or derivative of 4-nityl-1-naphthol as chromogenic group and application thereof UNIV CHONGQING MEDICAL 2013-03-20 CN claimed
CN-101443460-B Detection of molecular interactions using a reduced affinityenzyme complementation reporter system UNIV LELAND STANFORD JUNIOR 2013-03-06 CN disclosed
CN-101443460-A Detection of molecular interactions using a reduced affinityenzyme complementation reporter system UNIV LELAND STANFORD JUNIOR (US) 2009-05-27 CN disclosed
EP-0870054-B1 METHOD AND COMPOSITION FOR DETECTING BACTERIAL CONTAMINATION IN FOOD PRODUCTS BIOCONTROL SYSTEMS INC (US) 2008-07-30 EP disclosed
EP-0350808-B1 Method for detecting substances with hydrolase activity BOEHRINGER MANNHEIM GMBH (DE) 1995-11-08 EP disclosed