SCHEMBL77762

SCHEMBL77762

CC1=C(c2ccccc2NS(=O)(=O)c2c(C)cc(C)cc2C)C(=O)CC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
MCOLN3 Q8TDD5 3/20 0.62
TSHR P16473 5/20 0.51
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
CYP2C19 P33261 3/20 0.51
CYP1A2 P05177 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2D6 P10635 1/20 0.51
BLM P54132 1/20 0.51
ALDH1A1 P00352 6/20 0.50
HTT P42858 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
TDP1 Q9NUW8 2/20 0.45
CYTH2 Q99418 1/20 0.45
MAPT P10636 5/20 0.44
GAA P10253 2/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44

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
SCHEMBL77422 0.88 LMNA (0.50) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL79057 0.84 LMNA (0.45) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL77966 0.84 LMNA (0.47) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL76978 0.82 LMNA (0.67) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL79126 0.80 LMNA (0.62) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL2518910 0.77 LMNA (1.00) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL9175856 0.74 SMN1; SMN2 (0.64) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL27737802 0.73 LMNA (0.56) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL77967 0.72 LMNA (0.51) LMNAMCOLN3MEN1KMT2ACYP2C19
SCHEMBL5612820 0.68 LMNA (0.50) LMNASMN1; SMN2MCOLN3TSHRMEN1

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 5 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
WO-2007007992-A1 TRANSITION METAL COMPLEXES, CATALYST COMPOSITIONS CONTAINING THE SAME, AND OLEFIN POLYMERIZATION USING THE CATALYST COMPOSITIONS LG CHEM, LTD. (KR) 2007-01-18 WO 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