SCHEMBL4596648

SCHEMBL4596648

Nc1nc(N)nc(N)n1.[PbH2]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.47
LMNA P02545 2/20 0.42
ADORA2A P29274 2/20 0.40
ADORA1 P30542 2/20 0.40
POLB P06746 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2B P29275 1/20 0.40
CYP1A2 P05177 1/20 0.38
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
KDM4E B2RXH2 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALOX15 P16050 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HTR2B P41595 1/20 0.31

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
SCHEMBL8356506 0.94 CASP1 (0.50) CASP1LMNAADORA2AADORA1POLB
SCHEMBL29485005 0.94
SCHEMBL9579151 0.94 CASP1 (0.50) CASP1LMNAADORA2AADORA1POLB
SCHEMBL175612 0.94 CASP1 (0.50) CASP1LMNAADORA2AADORA1POLB
SCHEMBL9583239 0.94 CASP1 (0.50) CASP1LMNAADORA2AADORA1POLB
SCHEMBL29876207 0.94
SCHEMBL29900242 0.94
SCHEMBL25853 0.94
SCHEMBL8465809 0.94 CASP1 (0.50) CASP1LMNAADORA2AADORA1POLB
Hydrochloric Acid SCHEMBL3338896 0.89 CASP1 (0.47) CASP1LMNAADORA2AADORA1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117181077-A Smokeless sulfur-free firework whistle agent mixing device and method 万载县建坤化工有限公司 2023-12-08 CN claimed
CN-117181077-A Smokeless sulfur-free firework whistle agent mixing device and method 万载县建坤化工有限公司 2023-12-08 CN disclosed
CN-110820074-B Method for preparing urea compound modified melamine fiber by base catalysis 中原工学院 2022-07-15 CN disclosed
CN-110820074-A Method for preparing urea compound modified melamine fiber by base catalysis 中原工学院 2020-02-21 CN disclosed
EP-1874878-B1 PROCESS FOR THE COATING OF METALLIC COMPONENTS WITH AN AQUEOUS ORGANIC COMPOSITION CHEMETALL GMBH (DE) 2017-07-12 EP disclosed
CN-103439383-A Novel preparation method for electrochemical sensor used for detecting melamine based on indium tin oxide electrode modified by gold nanoparticles WUXI BAILING SENSOR TECHNOLOGY CO LTD 2013-12-11 CN disclosed
CN-100497048-C Gas generator NIPPON KAYAKU KK (JP) 2009-06-10 CN disclosed
EP-1874878-A1 PROCESS FOR THE COATING OF METALLIC COMPONENTS WITH AN AQUEOUS ORGANIC COMPOSITION Chemetall GmbH (DE) 2008-01-09 EP disclosed
CN-1938180-A Gas generator NIPPON KAYAKU KK (JP) 2007-03-28 CN disclosed
WO-2006108657-A1 PROCESS FOR THE COATING OF METALLIC COMPONENTS WITH AN AQUEOUS ORGANIC COMPOSITION CHEMETALL GMBH (DE) 2006-10-19 WO disclosed
EP-0274464-A1 METHOD AND APPARATUS FOR APPLYING POWDERED MATERIALS TO FILAMENTS. JAGER GUI G DE (NL) 1988-07-20 EP disclosed
WO-1987000563-A1 METHOD AND APPARATUS FOR APPLYING POWDERED MATERIALS TO FILAMENTS FLEXLINE SERVICES LTD. (CY) 1987-01-29 WO disclosed