SCHEMBL27737802

SCHEMBL27737802

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MCOLN3 Q8TDD5 3/20 0.56
TSHR P16473 5/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CYP2C19 P33261 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
BLM P54132 1/20 0.44
ALDH1A1 P00352 6/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 4/20 0.41
TP53 P04637 2/20 0.41
GAA P10253 2/20 0.41
CYTH2 Q99418 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL27716799 0.86 LMNA (0.40) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL27716802 0.86 LMNA (0.42) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL28771355 0.84 LMNA (0.59) LMNASMN1; SMN2MCOLN3TSHRCYP2C19
SCHEMBL28775617 0.83 LMNA (0.40) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL77762 0.73 LMNA (0.62) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL2518910 0.73 LMNA (1.00) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL27716801 0.72 MAPT (0.41) LMNAMEN1KMT2ACYP2C19ALDH1A1
SCHEMBL27716800 0.72 KMT2A (0.43) LMNAMCOLN3MEN1KMT2ACYP2C19
SCHEMBL79126 0.71 LMNA (0.62) LMNASMN1; SMN2MCOLN3TSHRMEN1
SCHEMBL28771354 0.70 ALDH1A1 (0.40) LMNAMCOLN3MEN1KMT2ACYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101223195-B Transition metal complexes, catalyst compositions containing the same, and olefin polymerization using the catalyst compositions LG CHEMICAL LTD 2011-10-26 CN disclosed
CN-101223195-A Transition metal complexes, catalyst compositions containing the same, and olefin polymerization using the catalyst compositions LG CHEMICAL LTD (KR) 2008-07-16 CN disclosed