SCHEMBL77919

SCHEMBL77919

CC1=CCC(C)=C1c1cc(F)ccc1NS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
LMNA P02545 3/20 0.47
KMT2A Q03164 3/20 0.47
TP53 P04637 2/20 0.47
MEN1 O00255 2/20 0.47
HTT P42858 1/20 0.47
POLB P06746 2/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NOD2 Q9HC29 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
CA12 O43570 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
FFAR4 Q5NUL3 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
SCHEMBL78568 0.83 LMNA (0.67) MAPTLMNAKMT2AHTTPOLB
SCHEMBL79131 0.81 MAPT (0.47) MAPTLMNAKMT2ATP53MEN1
SCHEMBL5956006 0.76 KEAP1 (0.58) MAPTLMNAKMT2ATP53MEN1
SCHEMBL76789 0.76 LMNA (0.49) MAPTLMNAKMT2ATP53MEN1
SCHEMBL77849 0.75 LMNA (0.43) MAPTLMNAKMT2ATP53MEN1
SCHEMBL10305011 0.73 ALDH1A1 (0.71) MAPTLMNAPOLBUSP2ALDH1A1
SCHEMBL28610415 0.72 KEAP1 (0.54) MAPTLMNAKMT2ATP53MEN1
SCHEMBL7579899 0.72 CA1 (0.60) MAPTLMNAKMT2ATP53MEN1
SCHEMBL8695450 0.72 KMT2A (0.61) MAPTLMNAKMT2ATP53MEN1
SCHEMBL27716800 0.72 KMT2A (0.43) MAPTLMNAKMT2ATP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129488-B2 Transition metal complexes, catalyst compositions containing the same, and olefin polymerization using the catalyst compositions LG CHEM, LTD. (KR) 2012-03-06 US disclosed
US-20090209712-A1 TRANSITION METAL COMPLEXES, CATALYST COMPOSITIONS CONTAINING THE SAME, AND OLEFIN POLYMERIZATION USING THE CATALYST COMPOSITIONS LG CHEM., LTD. (KR) 2009-08-20 US disclosed
US-7538239-B2 Transition metal complexes, catalyst compositions containing the same, and olefin polymerization using the catalyst compositions LG CHEM, LTD. (KR) 2009-05-26 US disclosed
US-20070010637-A1 Transition metal complexes, catalyst compositions containing the same, and olefin polymerization using the catalyst compositions LG CHEM, LTD. (KR) 2007-01-11 US disclosed