SCHEMBL13809663

SCHEMBL13809663

COc1ccc(C(=O)OCC(COC(=O)c2ccc(OC)c(OC)c2OC)OC(=O)c2ccc(OC)c(OC)c2OC)c(OC)c1OC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.51
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
ALDH1A1 P00352 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
PDE4D Q08499 2/20 0.45
PTPN1 P18031 2/20 0.45
MAPT P10636 3/20 0.43
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
LMNA P02545 2/20 0.42
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
TUBB1 Q9H4B7 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SERPINE1 P05121 1/20 0.39

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
SCHEMBL13809675 0.91 PKM (0.53) PKMKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL13809659 0.88 PKM (0.53) PKMKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL13809678 0.82 PTPN1 (0.47) PKMKMT2AALDH1A1PTPN1MAPT
SCHEMBL6613660 0.80 KMT2A (0.59) PKMKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL2612564 0.79 ALDH1A1 (0.51) KMT2AALDH1A1L3MBTL1PTPN1MAPT
SCHEMBL13809646 0.79 POLB (0.52) PKMKMT2AALDH1A1L3MBTL1PTPN1
SCHEMBL13809649 0.78 KMT2A (0.59) KMT2AMEN1L3MBTL1PTPN1POLB
SCHEMBL13809655 0.78 POLB (0.51) PKMKMT2AALDH1A1L3MBTL1PTPN1
SCHEMBL27774545 0.77 KMT2A (0.56) PKMKMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL13809660 0.77 KMT2A (0.61) PKMKMT2AMEN1ALDH1A1PTPN1

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-20090155495-A1 PROCESS FOR PRODUCING CELLULOSE ACYLATE FILM, CELLULOSE ACYLATE FILM, POLARIZER, AND LIQUID-CRYSTAL DISPLAY KONICA MINOLTA OPTO, INC. (JP) 2009-06-18 US disclosed
US-20090155495-A1 PROCESS FOR PRODUCING CELLULOSE ACYLATE FILM, CELLULOSE ACYLATE FILM, POLARIZER, AND LIQUID-CRYSTAL DISPLAY KONICA MINOLTA OPTO, INC. (JP) 2009-06-18 US disclosed