SCHEMBL13809653

SCHEMBL13809653

COc1cccc(OC)c1C(=O)OCC(COC(=O)c1ccccc1)OC(=O)c1c(OC)cccc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
PTPN1 P18031 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
ADRB2 P07550 3/20 0.44
ADRB1 P08588 3/20 0.44
ADRB3 P13945 3/20 0.44
SERPINE1 P05121 1/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 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
SCHEMBL13809640 0.99 ALDH1A1 (0.50) ALDH1A1PTPN1L3MBTL1POLBHTT
SCHEMBL13809654 0.92 CA12 (0.49) ALDH1A1PTPN1L3MBTL1NPSR1CA12
SCHEMBL13809672 0.90 PTPN1 (0.49) ALDH1A1PTPN1L3MBTL1POLBHTT
SCHEMBL13809661 0.88 PTPN1 (0.50) ALDH1A1PTPN1L3MBTL1POLBHTT
SCHEMBL13809668 0.87 PTPN1 (0.49) ALDH1A1PTPN1L3MBTL1POLBHTT
SCHEMBL13809673 0.85 PTPN1 (0.47) ALDH1A1PTPN1L3MBTL1POLBHTT
SCHEMBL13809615 0.84 PTPN1 (0.51) ALDH1A1PTPN1L3MBTL1POLBHTT
SCHEMBL13809655 0.82 POLB (0.51) ALDH1A1PTPN1L3MBTL1POLBHTT
Tribenzoin SCHEMBL28609 0.81 ALDH1A1 (0.67) ALDH1A1PTPN1L3MBTL1KMT2AMEN1
SCHEMBL13809646 0.81 POLB (0.52) ALDH1A1PTPN1L3MBTL1POLBHTT

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