SCHEMBL947522

SCHEMBL947522

CCCCc1cc(OCC)ccc1C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.51
GABRD O14764 1/20 0.51
GABRA1 P14867 1/20 0.51
GABRB1 P18505 1/20 0.51
GABRG2 P18507 1/20 0.51
GABRB3 P28472 1/20 0.51
GABRA5 P31644 1/20 0.51
GABRA3 P34903 1/20 0.51
GABRA2 P47869 1/20 0.51
GABRB2 P47870 1/20 0.51
GABRA4 P48169 1/20 0.51
GABRE P78334 1/20 0.51
GABRA6 Q16445 1/20 0.51
GABRG1 Q8N1C3 1/20 0.51
GABRG3 Q99928 1/20 0.51
GABRQ Q9UN88 1/20 0.51
HPSE Q9Y251 2/20 0.50
PTPN11 Q06124 4/20 0.49
LTB4R Q15722 1/20 0.48
LTB4R2 Q9NPC1 1/20 0.48

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
SCHEMBL946819 0.91 KDM4E (0.50) HPSEPTPN11LTB4RLTB4R2TSHR
SCHEMBL15344614 0.90 PTPN11 (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL1990568 0.86 HPSE (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL686360 0.85 KDM4E (0.54) LTB4RLTB4R2TSHRKDM4EALDH1A1
SCHEMBL10367941 0.85 LTB4R (0.61) PTPN11LTB4RLTB4R2ALDH1A1HPGD
SCHEMBL28555724 0.84 PTPN11 (0.53) HPSEPTPN11TSHRTP53PLA2G4B
SCHEMBL28622015 0.84 LTB4R (0.47) PTPN11LTB4RLTB4R2TSHRKDM4E
SCHEMBL1022635 0.84 PTPN11 (0.55) PTPN11TSHRKDM4EALDH1A1SMN1; SMN2
SCHEMBL9064238 0.83 PTPN11 (0.59) PTPN11TSHRTP53PLA2G4BRARA
SCHEMBL8949684 0.82 PTPN11 (0.60) HPSEPTPN11TSHRTP53PLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2958950-B1 AN IMPROVED MAGNESIUM DICHLORIDE SUPPORTED TITANIUM CATALYST COMPOSITION FOR POLYOLEFIN POLYMERIZATION RELIANCE INDUSTRIES LTD (IN) 2019-09-11 EP claimed
US-8569195-B2 Internal and external donor compounds for olefin polymerization catalysts II BASF CORPORATION (US) 2013-10-29 US claimed
EP-2782938-B1 HIGH ACTIVITY CATALYST FOR OLEFIN POLYMERIZATION BASF CORP (US) 2016-08-31 EP disclosed
EP-2257576-B1 A PROCESS FOR THE SYNTHESIS OF ALPHA-OLEFIN POLYMERIZATION PROCATALYSTS RELIANCE IND LTD (IN) 2013-02-20 EP disclosed
US-8283424-B2 Process for the synthesis of alpha-olefin polymerization procatalysts RELIANCE INDUSTRIES LIMITED (IN) 2012-10-09 US disclosed
US-20110015355-A1 PROCESS FOR THE SYNTHESIS OF ALPHA-OLEFIN POLYMERIZATION PROCATALYSTS RELIANCE INDUSTRIES LIMITED (IN) 2011-01-20 US disclosed
EP-2257576-A2 A PROCESS FOR THE SYNTHESIS OF ALPHA-OLEFIN POLYMERIZATION PROCATALYSTS Reliance Industries Limited (IN) 2010-12-08 EP disclosed
WO-2009116057-A2 A PROCESS FOR THE SYNTHESIS OF ALPHA-OLEFIN POLYMERIZATION PROCATALYSTS RELIANCE INDUSTRIES LIMITED (IN) 2009-09-24 WO disclosed
US-4232139-A Process for producing polymers or copolymers of olefins containing at least 3 carbon atoms MITSUI PETROCHEMICAL INDUSTRIES LTD. (JP) 1980-11-04 US disclosed
US-4229558-A HAVING HIGH ISOTACTIC INDEX BY USING A CATALYST PREPARED FROM A MAGNESIUM GRIGNARD REAGENT, TITANIUM HALIDE AN ETHER AND A CARBOXYLIC ESTER COMBINED WITH AN ORGANOALUMINUM COMPOUND MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1980-10-21 US disclosed