SCHEMBL6846887

SCHEMBL6846887

CCN(OP(=O)(O)O)c1cccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 3/20 0.36
SCN2A Q99250 3/20 0.36
SCN3A Q9NY46 3/20 0.36
PTPN5 P54829 1/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 1/20 0.34
PTPN1 P18031 1/20 0.34
KEAP1 Q14145 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
HNF4A P41235 1/20 0.33
GAA P10253 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL6848277 0.82 MEN1 (0.37) PTPN5ALDH1A1MAPTPDCD1CD274
SCHEMBL2855667 0.73 MEN1 (0.45) ALDH1A1MAPTHPGDHTTL3MBTL1
SCHEMBL16559081 0.73 NR3C1 (0.42) SCN1ASCN2ASCN3AALDH1A1HPGD
SCHEMBL30666143 0.70 SCN1A (0.39) SCN1ASCN2ASCN3AALDH1A1MAPT
Phosphoric Acid SCHEMBL242261 0.70 HNF4A (0.48) PTPN5ALDH1A1MAPTHPGDPTPN1
Phosphoric Acid SCHEMBL27982532 0.68 HDAC4 (0.45) PTPN5ALDH1A1MAPTHPGDHNF4A
SCHEMBL29604346 0.67 INPPL1 (0.52) PTPN5ALDH1A1HPGDHNF4AL3MBTL1
SCHEMBL4451434 0.67 INPPL1 (0.52) PTPN5ALDH1A1HPGDHNF4AL3MBTL1
SCHEMBL11406555 0.67 ACP3 (0.50) PTPN5PDCD1CD274HNF4AMAPK1
SCHEMBL6724502 0.67 ALDH1A1 (0.40) ALDH1A1MAPTHPGDPDCD1CD274

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-20040249029-A1 Flameproofing agent for polyester-based textile product and method of flameproofing DAIKYO CHEMICAL CO., LTD. (JP) 2004-12-09 US disclosed