SCHEMBL8467713

SCHEMBL8467713

COc1ccc(Nc2ccc(N3C(=O)C=CC3=O)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.79
HSP90AA1 P07900 2/20 0.64
MAPT P10636 6/20 0.59
GAA P10253 4/20 0.59
KDM4E B2RXH2 3/20 0.59
NPC1 O15118 2/20 0.59
RAB9A P51151 2/20 0.59
RECQL P46063 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
MAPK1 P28482 2/20 0.59
THRB P10828 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
FAAH O00519 1/20 0.52
POLB P06746 1/20 0.51
ALDH1A1 P00352 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NR4A1 P22736 1/20 0.50
NR1H2 P55055 1/20 0.50
NR1H3 Q13133 1/20 0.50

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
SCHEMBL136617 0.89 MGLL (1.00) MGLLHSP90AA1TDP1MAPK1NPSR1
SCHEMBL28071934 0.87 MGLL (0.96) MGLLHSP90AA1TDP1MAPK1NPSR1
SCHEMBL12321793 0.85 HSP90AA1 (0.84) MGLLHSP90AA1TDP1MAPK1NPSR1
SCHEMBL28454152 0.84 MGLL (0.89) MGLLHSP90AA1MAPTRAB9ATDP1
SCHEMBL8467804 0.82 HSP90AA1 (0.58) MGLLHSP90AA1MAPTGAAKDM4E
SCHEMBL8467244 0.80 MGLL (0.77) MGLLHSP90AA1TDP1MAPK1NPSR1
SCHEMBL10953934 0.79 MGLL (0.79) MGLLHSP90AA1MAPTKDM4ENPC1
SCHEMBL30974533 0.79 NR1H3 (0.68) MAPTGAAKDM4ENPC1RAB9A
SCHEMBL29250852 0.79 NR1H3 (0.68) MAPTGAAKDM4ENPC1RAB9A
SCHEMBL571682 0.78 HSP90AA1 (1.00) MGLLHSP90AA1TDP1MAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5936038-A MIXTURE CONTAINING ELASTOMER HAVING PENDANT REACTIVE AMINE GROUP AND PHENOLIC RESIN CURATIVE THE UNIVERSITY OF AKRON (US) 1999-08-10 US claimed
US-5936038-A MIXTURE CONTAINING ELASTOMER HAVING PENDANT REACTIVE AMINE GROUP AND PHENOLIC RESIN CURATIVE THE UNIVERSITY OF AKRON (US) 1999-08-10 US disclosed
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