SCHEMBL6846138

SCHEMBL6846138

NC(=O)c1c(-c2ccccc2)cc(-c2ccccc2)cc1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 2/20 0.53
IKBKB O14920 9/20 0.53
CHUK O15111 6/20 0.53
IKBKE Q14164 1/20 0.53
PKMYT1 Q99640 1/20 0.53
DHODH Q02127 2/20 0.52
PTPN1 P18031 1/20 0.52
MKNK1 Q9BUB5 2/20 0.49
CHEK2 O96017 1/20 0.49
PTGS1 P23219 1/20 0.46
MKNK2 Q9HBH9 1/20 0.44
BACE1 P56817 1/20 0.43
POLB P06746 1/20 0.43
CYP3A4 P08684 1/20 0.43
PARP1 P09874 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
CYP2C19 P33261 1/20 0.43
RECQL P46063 1/20 0.43
BLM P54132 1/20 0.43

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
SCHEMBL6842022 0.83 BCAT2 (0.63) BCAT2IKBKBDHODHPOLBCYP3A4
SCHEMBL31457344 0.83 PTPN1 (0.60) IKBKBCHUKIKBKEPKMYT1DHODH
SCHEMBL10029662 0.83 PTPN1 (0.55) BCAT2IKBKBCHUKIKBKEPKMYT1
SCHEMBL28409504 0.79 SMN1; SMN2 (0.52) IKBKBCHUKIKBKEPKMYT1PTPN1
SCHEMBL2783777 0.79 BCAT2 (0.58) BCAT2IKBKBCHUKIKBKEPKMYT1
SCHEMBL23489191 0.78 AKR1C2 (0.53) BCAT2IKBKBCHUKIKBKEPKMYT1
SCHEMBL28357636 0.77 BCAT2 (0.47) BCAT2IKBKBCHUKIKBKEPKMYT1
SCHEMBL29045606 0.76 PTPN1 (0.68) IKBKBCHUKIKBKEPKMYT1PTPN1
SCHEMBL15057946 0.76 PTPN1 (0.49) BCAT2IKBKBCHUKIKBKEPKMYT1
SCHEMBL28475228 0.76 BCAT2 (0.50) BCAT2IKBKBCHUKIKBKEPKMYT1

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
US-6696380-B2 Procatalysts, catalyst systems, and use in olefin polymerization WESTLAKE LONGVIEW CORPORATION 2004-02-24 US disclosed
US-6677410-B2 COORDINATION CATALYSTS EASTMAN CHEMICAL COMPANY 2004-01-13 US disclosed
US-20030004285-A1 Procatalysts, catalyst systems, and use in olefin polymerization WESTLAKE LONGVIEW CORPORATION 2003-01-02 US disclosed
US-6465383-B2 COORDINATION CATALYST EASTMAN CHEMICAL COMPANY 2002-10-15 US disclosed
US-20010051587-A1 Procatalysts, catalyst systems, and use in olefin polymerization WESTLAKE LONGVIEW CORPORATION 2001-12-13 US disclosed
US-20010031841-A1 Procatalysts, catalyst systems, and use in olefin polymerization WESTLAKE LONGVIEW CORPORATION 2001-10-18 US disclosed
US-20010029286-A1 Procatalysts, catalyst systems, and use in OLEFIN polymerization EASTMAN CHEMICAL COMPANY, A CORP. OF DELAWARE 2001-10-11 US disclosed
US-20010025005-A1 Procatalysts, catalyst systems, and use in olefin polymerization EASTMAN CHEMICAL COMPANY, A CORPORATION OF DELAWARE 2001-09-27 US disclosed
WO-2001051526-A1 PROCATALYSTS COMPRISING BIDENTATE LIGANDS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed
WO-2001051527-A1 PROCATALYSTS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed
WO-2001051529-A1 PROCATALYSTS COMPRISING BIDENTATE LIGANDS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed
WO-2001051528-A1 PROCATALYSTS COMPRISING BIDENTATE LIGANDS, CATALYST SYSTEMS, AND USE IN OLEFIN POLYMERIZATION EASTMAN CHEMICAL COMPANY (US) 2001-07-19 WO disclosed