SCHEMBL13809649

SCHEMBL13809649

COc1ccc(C(=O)OCC(COC(=O)c2ccc(OC)cc2OC)OC(=O)c2ccc(OC)cc2OC)c(OC)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.59
MEN1 O00255 5/20 0.59
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
USP2 O75604 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
CASP3 P42574 1/20 0.51
SENP8 Q96LD8 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
PTPN1 P18031 1/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
POLB P06746 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL13809639 0.91 NPC1 (0.54) KMT2AMEN1NPC1RAB9AUSP2
SCHEMBL13809641 0.90 NPC1 (0.55) KMT2AMEN1NPC1RAB9AUSP2
SCHEMBL30822790 0.85 KMT2A (0.55) KMT2AMEN1NPC1RAB9AL3MBTL1
SCHEMBL13809660 0.82 KMT2A (0.61) KMT2AMEN1SMN1; SMN2PTPN1LMNA
SCHEMBL11241762 0.82 KMT2A (0.68) KMT2AMEN1NPC1RAB9AUSP2
SCHEMBL13130501 0.81 PTPN1 (0.52) KMT2AMEN1TP53PTPN1LMNA
SCHEMBL13667972 0.81 TSHR (0.47) KMT2AMEN1NPC1RAB9AUSP2
SCHEMBL2612564 0.81 ALDH1A1 (0.51) KMT2ANPC1RAB9AL3MBTL1PTPN1
SCHEMBL7488349 0.80 KMT2A (0.67) KMT2AMEN1NPC1RAB9AUSP2
SCHEMBL28279136 0.79 KMT2A (0.60) KMT2AMEN1NPC1RAB9ASMN1; SMN2

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