SCHEMBL79131

SCHEMBL79131

CC1=C(c2cc(F)ccc2NS(=O)(=O)c2ccc(C)cc2)C(=O)CC1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
KMT2A Q03164 4/20 0.47
LMNA P02545 3/20 0.47
TP53 P04637 2/20 0.47
HTT P42858 1/20 0.47
POLB P06746 2/20 0.47
KEAP1 Q14145 2/20 0.47
NFE2L2 Q16236 2/20 0.47
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 2/20 0.47
USP2 O75604 1/20 0.47
CYP2C9 P11712 1/20 0.47
NOD2 Q9HC29 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MEN1 O00255 3/20 0.45
CA12 O43570 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 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
SCHEMBL78542 0.91 KMT2A (0.45) MAPTKMT2ALMNATP53HTT
SCHEMBL77967 0.90 LMNA (0.51) MAPTKMT2ALMNAHTTPOLB
SCHEMBL77966 0.85 LMNA (0.47) MAPTKMT2ALMNATP53HTT
SCHEMBL76978 0.83 LMNA (0.67) MAPTKMT2ALMNAHTTPOLB
SCHEMBL77919 0.81 MAPT (0.47) MAPTKMT2ALMNATP53HTT
SCHEMBL5956006 0.76 KEAP1 (0.58) MAPTKMT2ALMNATP53HTT
SCHEMBL77422 0.76 LMNA (0.50) MAPTKMT2ALMNATP53HTT
SCHEMBL79057 0.75 LMNA (0.45) MAPTKMT2ALMNATP53HTT
SCHEMBL27716800 0.74 KMT2A (0.43) MAPTKMT2ALMNATP53HTT
SCHEMBL10305011 0.73 ALDH1A1 (0.71) MAPTLMNAPOLBKEAP1NFE2L2

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