SCHEMBL5607436

SCHEMBL5607436

CCCCCCC(COC)(COC)C1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.35
NAAA Q02083 3/20 0.34
CNR1 P21554 1/20 0.33
SPHK2 Q9NRA0 2/20 0.31
SPHK1 Q9NYA1 1/20 0.31
CCR2 P41597 2/20 0.30
CCR1 P32246 1/20 0.30
CCR5 P51681 1/20 0.30
CXCR4 P61073 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL5606777 1.00 CYP1A2 (0.35) CYP1A2NAAACNR1SPHK2SPHK1
SCHEMBL13517858 0.98 CYP1A2 (0.38) CYP1A2NAAACNR1SPHK2SPHK1
SCHEMBL5607285 0.98 CYP1A2 (0.36) CYP1A2NAAACNR1
SCHEMBL5606779 0.96 CYP1A2 (0.39) CYP1A2NAAACNR1SPHK2SPHK1
SCHEMBL3967455 0.93 CYP1A2 (0.38) CYP1A2
SCHEMBL3971024 0.91 CYP1A2 (0.41) CYP1A2NAAA
SCHEMBL5606813 0.91 CYP1A2 (0.41) CYP1A2NAAA
SCHEMBL1276325 0.85 CYP1A2 (0.31) CYP1A2
SCHEMBL13518452 0.84 CYP1A2 (0.34) CYP1A2NAAACNR1ALDH1A1TDP1
SCHEMBL1196417 0.83 CYP1A2 (0.34) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395617-B1 COMPONENTS AND CATALYSTS FOR THE (CO)POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SPA (IT) 2013-04-10 EP claimed
US-6841632-B2 Components and catalysts for the (co)polymerization of olefins BASELL POLIOLEFINE ITALIS S.P.A. (IT) 2005-01-11 US claimed
EP-1395617-A1 COMPONENTS AND CATALYSTS FOR THE (CO)POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.p.A. (IT) 2004-03-10 EP claimed
US-20040014597-A1 Components and catalysts for the (co) polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A (IT) 2004-01-22 US claimed
WO-2002100904-A1 COMPONENTS AND CATALYSTS FOR THE (CO)POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.P.A (IT) 2002-12-19 WO claimed
EP-1395617-B1 COMPONENTS AND CATALYSTS FOR THE (CO)POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE SPA (IT) 2013-04-10 EP disclosed
US-8394734-B2 Solid catalyst for propylene polymerization and a method for preparation of polypropylene using the same SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2013-03-12 US disclosed
US-20120277389-A1 SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND A METHOD FOR PREPARATION OF POLYPROPYLENE USING THE SAME SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2012-11-01 US disclosed
US-7223712-B2 Catalyst component for the (CO)polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2007-05-29 US disclosed
US-20050107245-A1 Catalyst component for the (CO)polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2005-05-19 US disclosed
US-6841632-B2 Components and catalysts for the (co)polymerization of olefins BASELL POLIOLEFINE ITALIS S.P.A. (IT) 2005-01-11 US disclosed
EP-1395617-A1 COMPONENTS AND CATALYSTS FOR THE (CO)POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.p.A. (IT) 2004-03-10 EP disclosed
US-20040014597-A1 Components and catalysts for the (co) polymerization of olefins BASELL POLIOLEFINE ITALIA S.P.A (IT) 2004-01-22 US disclosed
WO-2002100904-A1 COMPONENTS AND CATALYSTS FOR THE (CO)POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.P.A (IT) 2002-12-19 WO disclosed