SCHEMBL18316005

SCHEMBL18316005

O=S(=O)([O-])Oc1ccc(O)c2ncccc12.O=S(=O)([O-])Oc1ccc(O)c2ncccc12.O=S(=O)([O-])Oc1ccc(O)c2ncccc12.[Al+3]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
COMT P21964 5/20 0.55
FTO Q9C0B1 3/20 0.55
KDM4E B2RXH2 9/20 0.53
HSP90AA1 P07900 4/20 0.53
L3MBTL1 Q9Y468 4/20 0.53
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
NPSR1 Q6W5P4 2/20 0.53
IDO1 P14902 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
BRD4 O60885 2/20 0.50
LMNA P02545 2/20 0.50
HTT P42858 2/20 0.50
METAP2 P50579 2/20 0.50
CTSB P07858 1/20 0.50
CHRM1 P11229 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
SCHEMBL6216338 0.86 COMT (0.60) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL10807684 0.85 COMT (0.55) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL1873348 0.78 COMT (0.71) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL6118557 0.76 KDM4E (0.59) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL2224753 0.76 HSP90AA1 (0.62) FTOKDM4EHSP90AA1L3MBTL1NPC1
SCHEMBL3271681 0.75 COMT (0.71) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL10728571 0.75 COMT (0.71) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL9511332 0.75 FTO (0.77) COMTFTOKDM4EHSP90AA1L3MBTL1
Potassium Ion SCHEMBL31267529 0.75 COMT (0.71) COMTFTOKDM4EHSP90AA1L3MBTL1
SCHEMBL7151881 0.75 COMT (0.71) COMTFTOKDM4EHSP90AA1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160370521-A1 BLUE LIGHT POLARIZATION FILM AND ITS MANUFACTURING METHOD, BLUE BACKLIGHT AND LIQUID CRYSTAL DISPLAY DEVICE BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-12-22 US claimed
US-20160370521-A1 BLUE LIGHT POLARIZATION FILM AND ITS MANUFACTURING METHOD, BLUE BACKLIGHT AND LIQUID CRYSTAL DISPLAY DEVICE BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-12-22 US disclosed
US-20160370521-A1 BLUE LIGHT POLARIZATION FILM AND ITS MANUFACTURING METHOD, BLUE BACKLIGHT AND LIQUID CRYSTAL DISPLAY DEVICE BOE TECHNOLOGY GROUP CO., LTD. (CN) 2016-12-22 US disclosed