SCHEMBL844439

SCHEMBL844439

O=C1Oc2ccc(Oc3ccccc3)cc2C1c1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
GSTP1 P09211 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
ACHE P22303 2/20 0.38
CYP19A1 P11511 1/20 0.38
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
KDM1A O60341 1/20 0.37
XDH P47989 1/20 0.36
MCL1 Q07820 1/20 0.36
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35

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
SCHEMBL2612465 0.89 GAA (0.66) GAAL3MBTL1NPC1POLBRAB9A
SCHEMBL5944578 0.78 GAA (0.67) GAANPC1POLBRAB9ACYP19A1
SCHEMBL824498 0.76 GAA (0.47) GAA
SCHEMBL8705412 0.76 GAA (0.59) GAAL3MBTL1NPC1POLBRAB9A
SCHEMBL8705410 0.74 GAA (0.57) GAAL3MBTL1CYP19A1MAPTTDP1
SCHEMBL13510764 0.73 GAA (0.43) GAAL3MBTL1NPC1POLBRAB9A
SCHEMBL19678639 0.72 NPSR1 (0.40) L3MBTL1NPC1POLBRAB9AACHE
SCHEMBL8711190 0.72 GAA (0.54) GAAL3MBTL1NPC1POLBRAB9A
SCHEMBL10481347 0.70 GAA (0.68) GAARAB9ACYP19A1MAPTALDH1A1
SCHEMBL571262 0.70 GAA (0.68) GAACYP19A1MAPTALDH1A1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8142864-B2 Cellulose ester pellets, cellulose ester film, manufacturing method of cellulose ester film, polarizing plate, and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2012-03-27 US disclosed
US-20100047480-A1 CELLULOSE ESTER PELLETS, CELLULOSE ESTER FILM, MANUFACTURING METHOD OF CELLULOSE ESTER FILM, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY C/O KONICA MINOLTA OPTO, INC. (JP) 2010-02-25 US disclosed