SCHEMBL6737288

SCHEMBL6737288

CCOC(=O)C(C(=O)OCC)C(c1ccccc1)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.47
ACP3 P15309 1/20 0.47
TACR1 P25103 4/20 0.45
MMP8 P22894 1/20 0.44
CNR2 P34972 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
SLC6A9 P48067 1/20 0.43
POLB P06746 1/20 0.42
LDHA P00338 1/20 0.42
LDHB P07195 1/20 0.42
PPARG P37231 3/20 0.42
FFAR1 O14842 2/20 0.42
EPHX2 P34913 2/20 0.42
HSD11B1 P28845 1/20 0.42
TSHR P16473 1/20 0.42
CACNA1A O00555 1/20 0.41
CACNA2D1 P54289 1/20 0.41
CACNA1B Q00975 1/20 0.41
CACNB1 Q02641 1/20 0.41
CACNA1C Q13936 1/20 0.41

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
SCHEMBL6880963 0.81 PDPK1 (0.60) PDPK1ACP3TACR1CNR2LDHA
SCHEMBL9511451 0.79 SMN1; SMN2 (0.43) ACP3TACR1SLC6A9POLB
SCHEMBL5348695 0.79 NPSR1 (0.47) NPSR1POLBPPARGFFAR1EPHX2
SCHEMBL28147664 0.79 NPSR1 (0.49) NPSR1POLBPPARGFFAR1EPHX2
SCHEMBL1043699 0.79 NPSR1 (0.49) MMP8NPSR1POLBPPARGFFAR1
SCHEMBL10869302 0.79 MMP8 (0.51) MMP8TSHR
SCHEMBL7090567 0.78 MMP8 (0.52) PDPK1ACP3TACR1MMP8NPSR1
SCHEMBL27103619 0.78 SLC6A9 (0.52) SLC6A9PPARGTSHRCACNA1C
SCHEMBL6809652 0.78 MMP8 (0.48) MMP8NPSR1POLBPPARGFFAR1
SCHEMBL6675458 0.77 CES2 (0.56) NPSR1POLBPPARGFFAR1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042372-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SPA (IT) 2004-07-14 EP claimed
US-6605562-B1 Comprising TiCl4, MgCl2 and an electron donor compound selected from heteroatom containing esters of malonic acids; heteroatoms are preferably selected from F, Cl, Br, and Si BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2003-08-12 US claimed
EP-1042372-B1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SPA (IT) 2004-07-14 EP disclosed
US-6699814-B2 CATALYST COMPRISING PRODUCT OF REACTION BETWEEN SOLID CATALYST COMPONENT COMPRISING MAGNESIUM, TITANIUM, HALOGEN AND HETEROATOM CONTAINING MALONATE, ALKYLALUMINUM COMPOUND AND, OPTIONALLY, ONE OR MORE ELECTRON-DONOR COMPOUNDS BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2004-03-02 US disclosed
US-6689850-B2 Process for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2004-02-10 US disclosed
US-20030207754-A1 Process for the polymerization of olefins MORINI GIAMPIERO (IT) 2003-11-06 US disclosed
US-20030207755-A1 Heteroatom containing malonates used in catalysts for the polymerization of olefins MORINI GIAMPIERO (IT) 2003-11-06 US disclosed
US-20030199388-A1 Catalysts for the polymerization of olefins EQUISTAR CHEMICALS, LP 2003-10-23 US disclosed
US-6605562-B1 Comprising TiCl4, MgCl2 and an electron donor compound selected from heteroatom containing esters of malonic acids; heteroatoms are preferably selected from F, Cl, Br, and Si BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2003-08-12 US disclosed
EP-1042372-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS Montell Technology Company bv (NL) 2000-10-11 EP disclosed
WO-2000026259-A1 COMPONENTS AND CATALYSTS FOR THE POLYMERIZATION OF OLEFINS MONTELL TECHNOLOGY COMPANY BV (NL) 2000-05-11 WO disclosed