SCHEMBL4145707

SCHEMBL4145707

Cn1c(=O)c2c(ncn2C)n(CN)c1=O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 0.77
PDE4A P27815 6/20 0.77
PDE4B Q07343 6/20 0.77
PDE4C Q08493 6/20 0.77
PDE4D Q08499 6/20 0.77
ADORA2B P29275 9/20 0.67
PIK3CD O00329 1/20 0.65
POLB P06746 1/20 0.65
ADORA3 P0DMS8 1/20 0.65
CNR1 P21554 1/20 0.65
ACHE P22303 1/20 0.65
ADORA1 P30542 1/20 0.65
NTSR1 P30989 1/20 0.65
MC3R P41968 1/20 0.65
NOTUM Q6P988 1/20 0.65
SIRT3 Q9NTG7 1/20 0.65
GDA Q9Y2T3 1/20 0.65
NR2E1 Q9Y466 1/20 0.65
BLM P54132 2/20 0.62
CYP1A2 P05177 1/20 0.62

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
SCHEMBL29904572 0.87 ADORA2B (0.68) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL21381247 0.87 PDE4A (1.00) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL16697212 0.85 ADORA2A (0.79) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL5463424 0.84 ADORA2A (0.72) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL16093733 0.83 ADORA2A (0.70) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL8861588 0.83 PDE4A (0.75) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL23974594 0.81 ADORA2A (0.68) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL515931 0.81 ADORA2A (0.68) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL5411063 0.81 ADORA2A (0.68) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL1200300 0.81 ADORA2A (0.68) ADORA2APDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117664689-B Method for analyzing or identifying sweet potato/tapioca starch based on nitrogen stable isotope 南京市食品药品监督检验院 2024-04-16 CN disclosed
CN-117664689-A Method for analyzing or identifying sweet potato/tapioca starch based on nitrogen stable isotope 南京市食品药品监督检验院 2024-03-08 CN disclosed
EP-3701800-B1 USE BARRY CALLEBAUT AG (CH) 2023-06-07 EP disclosed
EP-3701800-A1 USE Barry Callebaut AG (CH) 2020-09-02 EP disclosed
US-10701951-B2 Process of producing cocoa shell powder BARRY CALLEBAUT AG (CH) 2020-07-07 US disclosed
US-10477877-B2 Cocoa shell powder and process of making BARRY CALLEBAUT AG (CH) 2019-11-19 US disclosed
EP-2793599-B1 PROCESS BARRY CALLEBAUT AG (CH) 2019-05-29 EP disclosed
US-20180317516-A1 PROCESS, USE, AND PRODUCT BARRY CALLEBAUT AG (CH) 2018-11-08 US disclosed
US-9375024-B2 Process of producing cocoa shell powder BARRY CALLEBAUT AG (CH) 2016-06-28 US disclosed
US-20160135478-A1 PROCESS, USE, AND PRODUCT BARRY CALLEBAUT AG (CH) 2016-05-19 US disclosed
EP-2793599-A1 PROCESS, USE AND PRODUCT Barry Callebaut AG (CH) 2014-10-29 EP disclosed
US-8697171-B2 Preparation process of purified green-tea extract KAO CORPORATION (JP) 2014-04-15 US disclosed
US-20130302473-A1 PROCESS, USE AND PRODUCT BARRY CALLEBAUT AG (CH) 2013-11-14 US disclosed
WO-2013091121-A1 PROCESS, USE AND PRODUCT BARRY CALLEBAUT AG (CH) 2013-06-27 WO disclosed
US-20090104337-A1 PROCESS FOR PRODUCING PURIFIED GREEN TEA EXTRACT KAO CORPORATION (JP) 2009-04-23 US disclosed
US-20090081350-A1 PROCESS FOR PRODUCING PURIFIED GREEN TEA EXTRACT KAO CORPORATION (JP) 2009-03-26 US disclosed
EP-2008525-A1 PROCESS FOR PRODUCING PURIFIED GREEN TEA EXTRACT Kao Corporation (JP) 2008-12-31 EP disclosed
EP-2008524-A1 PROCESS FOR PRODUCING PURIFIED GREEN TEA EXTRACT Kao Corporation (JP) 2008-12-31 EP disclosed
US-20070059424-A1 Preparation process of purified green-tea extract KAO CORPORATION (JP) 2007-03-15 US disclosed