SCHEMBL13809646

SCHEMBL13809646

COc1cccc(C(=O)OCC(COC(=O)c2cccc(OC)c2OC)OC(=O)c2ccccc2)c1OC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
KMT2A Q03164 1/20 0.52
KDM4E B2RXH2 1/20 0.51
RAB9A P51151 2/20 0.47
NPC1 O15118 2/20 0.45
PTPN1 P18031 1/20 0.45
TSHR P16473 2/20 0.45
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 3/20 0.43
USP2 O75604 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
SLC6A3 Q01959 1/20 0.42

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
SCHEMBL13809655 0.99 POLB (0.51) POLBKMT2AKDM4ERAB9ANPC1
SCHEMBL13809659 0.89 PKM (0.53) POLBKMT2AKDM4ERAB9ANPC1
SCHEMBL13809615 0.88 PTPN1 (0.51) POLBKMT2ARAB9ANPC1PTPN1
SCHEMBL13809675 0.86 PKM (0.53) POLBKMT2AKDM4ERAB9ANPC1
SCHEMBL13809673 0.85 PTPN1 (0.47) POLBKMT2APTPN1TSHRALDH1A1
SCHEMBL13809668 0.84 PTPN1 (0.49) POLBKMT2APTPN1TSHRALDH1A1
SCHEMBL13809674 0.82 PTPN1 (0.60) KMT2APTPN1TSHRALDH1A1NPSR1
SCHEMBL13809648 0.82 PTPN1 (0.60) KMT2APTPN1TSHRALDH1A1NPSR1
SCHEMBL13809640 0.82 ALDH1A1 (0.50) POLBKMT2ANPC1PTPN1TSHR
SCHEMBL2612564 0.81 ALDH1A1 (0.51) KMT2ARAB9ANPC1PTPN1TSHR

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