SCHEMBL3677441

SCHEMBL3677441

CCc1c(N2C(=O)C=C(C)C2=O)cccc1N1C(=O)C=C(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.41
TSHR P16473 1/20 0.37
LMNA P02545 2/20 0.35
XPO1 O14980 2/20 0.34
ELANE P08246 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
MPI P34949 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 2/20 0.32
RGS12 O14924 1/20 0.32
PKM P14618 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TLR9 Q9NR96 1/20 0.31
CRHBP P24387 1/20 0.30

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
SCHEMBL20261770 0.84 MGLL (0.59) MGLLTSHRLMNAELANEMEN1
SCHEMBL3684398 0.82 MGLL (0.45) MGLLTSHRLMNAMEN1KMT2A
SCHEMBL3679861 0.82 MGLL (0.38) MGLLXPO1ALDH1A1HPGDMEN1
SCHEMBL7193393 0.81 TLR9 (0.48) MGLLTSHRXPO1MEN1KMT2A
SCHEMBL8886650 0.80 POLB (0.42) MGLLXPO1ELANEALDH1A1HPGD
SCHEMBL28480530 0.80 MGLL (0.37) MGLLXPO1ALDH1A1HPGDMEN1
SCHEMBL29778344 0.80 MGLL (0.42) MGLLTSHRLMNAXPO1ELANE
SCHEMBL9492119 0.77 MGLL (0.60) MGLLTSHRLMNAELANEALDH1A1
SCHEMBL30473083 0.77 MGLL (0.60) MGLLTSHRLMNAELANEALDH1A1
SCHEMBL2230828 0.76 MGLL (0.50) MGLLXPO1ALDH1A1PKMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100175805-A1 RUBBER COMPOSITION FOR COVERING TEXTILE CORD AND TIRE EMPLOYING THE SAME SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2010-07-15 US disclosed