SCHEMBL27770258

SCHEMBL27770258

Nc1ccc2oc3ccccc3c(=O)c2c1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.59
KDM4E B2RXH2 4/20 0.59
ALDH1A1 P00352 3/20 0.59
MAPT P10636 2/20 0.59
HPGD P15428 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
GLA P06280 1/20 0.59
CYP3A4 P08684 1/20 0.59
PGAM1 P18669 1/20 0.59
CASP1 P29466 1/20 0.59
CASP7 P55210 1/20 0.59
HSD17B10 Q99714 1/20 0.59
DDR2 Q16832 1/20 0.51
GAA P10253 2/20 0.50
NQO1 P15559 1/20 0.50
MGAM O43451 1/20 0.49
SI P14410 1/20 0.49
MGAM2 Q2M2H8 1/20 0.49
TBK1 Q9UHD2 1/20 0.48
KDM5A P29375 1/20 0.47

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
SCHEMBL2256950 0.85 KDM4E (0.52) MAOAKDM4EALDH1A1MAPTHPGD
SCHEMBL6354852 0.81 MAOA (0.63) MAOAKDM4EALDH1A1MAPTHPGD
SCHEMBL21763556 0.77 MAOA (0.47) MAOAKDM4EALDH1A1MAPTHPGD
Xanthone SCHEMBL41161 0.76 MAOA (1.00) MAOAKDM4EALDH1A1MAPTHPGD
SCHEMBL4696277 0.76 MAOA (0.90) MAOAKDM4EALDH1A1MAPTHPGD
Xanthone SCHEMBL29358061 0.76 MAOA (1.00) MAOAKDM4EALDH1A1MAPTHPGD
Xanthone SCHEMBL29398266 0.76 MAOA (1.00) MAOAKDM4EALDH1A1MAPTHPGD
Xanthone SCHEMBL2354794 0.76 MAOA (1.00) MAOAKDM4EALDH1A1MAPTHPGD
SCHEMBL3698658 0.74 MAOA (0.63) MAOAKDM4EALDH1A1MAPTHPGD
Xanthone SCHEMBL18556112 0.74 MAOA (0.95) MAOAKDM4EALDH1A1MAPTHPGD

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
CN-100513485-C Silicone rubber composition for electrode circuit protection, electrode circuit protection material, and electrical and electronic component SHINETSU CHEMICAL CO (JP) 2009-07-15 CN disclosed