SCHEMBL8995941

SCHEMBL8995941

CN(C)N(c1ccccc1)c1ccc(N2C(=O)C=CC2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 16/20 0.57
FAAH O00519 6/20 0.55
HSP90AA1 P07900 5/20 0.50
DDAH1 O94760 1/20 0.44
PKM P14618 2/20 0.44
MAPK1 P28482 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
ATM Q13315 2/20 0.43
HPGD P15428 1/20 0.43
XBP1 P17861 1/20 0.43
ALOX12 P18054 1/20 0.43
RUNX1 Q01196 1/20 0.43
CBFB Q13951 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
SCHEMBL7062361 0.86 MGLL (0.61) MGLLFAAHHSP90AA1DDAH1PKM
SCHEMBL3671951 0.82 MGLL (0.65) MGLLFAAHHSP90AA1DDAH1PKM
SCHEMBL7058806 0.78 MGLL (0.55) MGLLFAAHHSP90AA1DDAH1NPSR1
SCHEMBL3759716 0.77 MGLL (0.65) MGLLFAAHHSP90AA1DDAH1PKM
SCHEMBL3665727 0.77 MGLL (0.65) MGLLFAAHHSP90AA1DDAH1PKM
Benzene SCHEMBL28088808 0.74 MGLL (1.00) MGLLFAAHHSP90AA1DDAH1PKM
SCHEMBL8920586 0.74 MGLL (1.00) MGLLFAAHHSP90AA1DDAH1PKM
SCHEMBL18713 0.74 MGLL (1.00) MGLLFAAHHSP90AA1DDAH1PKM
SCHEMBL6277514 0.74 MEN1 (0.48) MGLLFAAHMAPK1NPSR1TDP1
SCHEMBL3672504 0.73 MGLL (0.71) MGLLFAAHHSP90AA1DDAH1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0570825-B1 Tire sidewall composition containing silica having low PH GOODYEAR TIRE & RUBBER (US) 1996-08-07 EP disclosed
EP-0475215-B1 Carboxylic acid esters with thio groups GOODYEAR TIRE & RUBBER (US) 1994-10-19 EP disclosed
EP-0570825-A1 Tire sidewall composition containing silica having low PH THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-11-24 EP disclosed
US-5244028-A Natural rubber or polybutadiene, silica, antidegradation agent, carbon black THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-09-14 US disclosed
US-5216049-A A phenolic or amine stabilizer and an organothioalkylene styrene bound to a polymer; aging resistance; rubbers THE GOODYEAR TIRE & RUBBER COMPANY (US) 1993-06-01 US disclosed
EP-0475215-A1 Carboxylic acid esters with thio groups THE GOODYEAR TIRE & RUBBER COMPANY (US) 1992-03-18 EP disclosed
US-5069819-A SYNERGISTS FOR CONVENTIONAL PHENOLIC AND AMINE ANTIOXIDANTS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1991-12-03 US disclosed