SCHEMBL6053706

SCHEMBL6053706

CC(C)(C)c1cc(CNCCCNCc2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.47
NR5A2 O00482 1/20 0.46
NR5A1 Q13285 1/20 0.46
GAA P10253 2/20 0.43
ALDH1A1 P00352 2/20 0.43
XBP1 P17861 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SCN2A Q99250 2/20 0.42
CYP2C19 P33261 6/20 0.41
HSPA5 P11021 2/20 0.41
CYP2C9 P11712 5/20 0.40
CYP2D6 P10635 4/20 0.40
CYP1A2 P05177 3/20 0.40
HIF1A Q16665 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 3/20 0.39
CYP3A4 P08684 1/20 0.39
CA2 P00918 3/20 0.39

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
SCHEMBL11593073 0.95 GSR (0.46) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL6053408 0.93 GSR (0.50) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL7943209 0.92 GSR (0.51) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL7940416 0.91 GSR (0.50) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL24871017 0.91 GSR (0.45) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL31043275 0.90 ALDH1A1 (0.47) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL7933905 0.89 GSR (0.62) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL18231358 0.88 CA12 (0.42) GSRNR5A2NR5A1GAAALDH1A1
SCHEMBL28789635 0.88 GSR (0.45) GSRNR5A2NR5A1GAAALDH1A1
Hydrochloric Acid SCHEMBL27821211 0.86 GSR (0.47) GSRNR5A2NR5A1GAAALDH1A1

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-1370591-B1 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS UNIV RAMOT (IL) 2006-08-02 EP claimed
EP-1370591-A4 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS UNIV RAMOT (IL) 2004-04-21 EP claimed
US-6686490-B1 NON-METALLOCENE PRE- CATALYST FEATURING A DIAMINE DIPHENOLATE COMPLEX RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 2004-02-03 US claimed
EP-1370591-A2 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS Ramot at Tel Aviv University Ltd. (IL) 2003-12-17 EP claimed
US-6632899-B2 Contains a diamine diphenolate complex and an activating co-catalyst RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2003-10-14 US claimed
US-20020173604-A1 Active non-metallocene pre-catalyst and method for tactic catalytic polymerization of alpha-olefin monomers RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2002-11-21 US claimed
WO-2002036638-A2 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 2002-05-10 WO claimed
EP-1370591-B1 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS UNIV RAMOT (IL) 2006-08-02 EP disclosed
EP-1370591-A4 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS UNIV RAMOT (IL) 2004-04-21 EP disclosed
US-6686490-B1 NON-METALLOCENE PRE- CATALYST FEATURING A DIAMINE DIPHENOLATE COMPLEX RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 2004-02-03 US disclosed
EP-1370591-A2 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS Ramot at Tel Aviv University Ltd. (IL) 2003-12-17 EP disclosed
US-6632899-B2 Contains a diamine diphenolate complex and an activating co-catalyst RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2003-10-14 US disclosed
US-20020173604-A1 Active non-metallocene pre-catalyst and method for tactic catalytic polymerization of alpha-olefin monomers RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2002-11-21 US disclosed
WO-2002036638-A2 ACTIVE NON-METALLOCENE PRE-CATALYST AND METHOD FOR TACTIC CATALYTIC POLYMERIZATION OF ALPHA-OLEFIN MONOMERS RAMOT UNIVERSITY AUTHORITY FOR APPLIED RESEARCH & INDUSTRIAL DEVELOPMENT LTD. (IL) 2002-05-10 WO disclosed