SCHEMBL83519

SCHEMBL83519

[CH2]C(C)(O)Cc1ccc(OCCO)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NR1I2 O75469 1/20 0.46
ALDH1A1 P00352 4/20 0.46
RECQL P46063 1/20 0.46
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
KMT2A Q03164 1/20 0.41
SLCO1B3 Q9NPD5 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
GAA P10253 1/20 0.40
ACACB O00763 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
APP P05067 3/20 0.37
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 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
SCHEMBL28356601 0.90 CYP3A4 (0.41) CYP3A4SMN1; SMN2ALDH1A1LMNAMEN1
SCHEMBL358896 0.86 CYP3A4 (0.53) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL12775672 0.84 CYP3A4 (0.59) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL127434 0.80 CYP3A4 (0.47) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL13819820 0.80 CYP3A4 (0.51) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL19644362 0.79 SMN1; SMN2 (0.50) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL788296 0.79 SMN1; SMN2 (0.50) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL7764968 0.78 CYP3A4 (0.45) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL1185992 0.78 CYP3A4 (0.49) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL
SCHEMBL23649892 0.77 CYP3A4 (0.51) CYP3A4SMN1; SMN2NR1I2ALDH1A1RECQL

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 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4723379-B2 2011-07-13 JP claimed
EP-1660019-B1 POLYMERIZABLE DENTAL COMPOSITION HAVING A HIGH CONTENT OF LOADING MATERIAL BLUESTAR SILICONES FRANCE (FR) 2010-07-14 EP claimed
EP-1609205-B1 SETTING COMPOSITION FOR A BATTERY ELECTROLYTE RHODIA CHIMIE SA (FR) 2010-04-28 EP claimed
JP-2007515377-A 2007-06-14 JP claimed
JP-2006522432-A 2006-09-28 JP claimed
EP-1660019-A1 POLYMERIZABLE DENTAL COMPOSITION HAVING A HIGH CONTENT OF LOADING MATERIAL Rhodia Chimie (FR) 2006-05-31 EP claimed
EP-1609205-A2 SETTING COMPOSITION FOR A BATTERY ELECTROLYTE Rhodia Chimie (FR) 2005-12-28 EP claimed
WO-2005027857-A1 POLYMERIZABLE DENTAL COMPOSITION HAVING A HIGH CONTENT OF LOADING MATERIAL RHODIA CHIMIE (FR) 2005-03-31 WO claimed
WO-2004091033-A2 SETTING COMPOSITION FOR A BATTERY ELECTROLYTE RHODIA CHIMIE (FR) 2004-10-21 WO claimed
EP-0998499-B1 NOVEL POLYMERISATION AND/OR CROSS-LINKING INITIATOR SYSTEMS COMPRISING AN ONIUM BORATE AND A BENZOPHENONE RHODIA CHIMIE SA (FR) 2004-09-22 EP claimed
EP-1117368-B1 DENTAL COMPOSITION BASED ON SILICONE CROSSLINKABLE BY CATION PROCESS RHODIA CHIMIE SA (FR) 2004-05-06 EP claimed
WO-2002097003-A1 PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS, METHOD FOR THE PREPARATION AND USE THEREOF RHODIA CHIMIE (FR) 2002-12-05 WO claimed
EP-1117368-A1 DENTAL COMPOSITION BASED ON SILICONE CROSSLINKABLE BY CATION PROCESS RHODIA CHIMIE (FR) 2001-07-25 EP claimed
EP-0998499-A1 NOVEL POLYMERISATION AND/OR CROSS-LINKING INITIATOR SYSTEMS COMPRISING AN ONIUM BORATE AND A BENZOPHENONE RHODIA CHIMIE (FR) 2000-05-10 EP claimed
WO-2000019967-A1 DENTAL COMPOSITION BASED ON SILICONE CROSSLINKABLE BY CATION PROCESS RHODIA CHIMIE (FR) 2000-04-13 WO claimed
WO-1999005181-A1 NOVEL POLYMERISATION AND/OR CROSS-LINKING INITIATOR SYSTEMS COMPRISING AN ONIUM BORATE AND A BENZOPHENONE RHODIA CHIMIE (FR) 1999-02-04 WO claimed
CN-115702218-A Infrared-absorbing ultraviolet-curable ink and infrared-absorbing printed matter 共同印刷株式会社 2023-02-14 CN disclosed
CN-115066470-A Infrared absorbing UV ink and method for producing same 共同印刷株式会社 2022-09-16 CN disclosed
WO-2000019967-A1 DENTAL COMPOSITION BASED ON SILICONE CROSSLINKABLE BY CATION PROCESS RHODIA CHIMIE (FR) 2000-04-13 WO disclosed
WO-1999005181-A1 NOVEL POLYMERISATION AND/OR CROSS-LINKING INITIATOR SYSTEMS COMPRISING AN ONIUM BORATE AND A BENZOPHENONE RHODIA CHIMIE (FR) 1999-02-04 WO disclosed