SCHEMBL13809668

SCHEMBL13809668

COc1ccc(OC)c(C(=O)OCC(COC(=O)c2ccccc2)OC(=O)c2ccccc2)c1OC

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.49
ALDH1A1 P00352 1/20 0.47
ADRB2 P07550 3/20 0.45
ADRB1 P08588 3/20 0.45
ADRB3 P13945 3/20 0.45
SERPINE1 P05121 1/20 0.43
PRKCA P17252 1/20 0.42
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.40
PTPN2 P17706 1/20 0.39
PTPN11 Q06124 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 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
SCHEMBL13809673 0.99 PTPN1 (0.47) PTPN1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL13809678 0.88 PTPN1 (0.47) PTPN1ALDH1A1SERPINE1KMT2APOLB
SCHEMBL13809659 0.88 PKM (0.53) PTPN1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL13809653 0.87 ALDH1A1 (0.49) PTPN1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL13809674 0.86 PTPN1 (0.60) PTPN1ALDH1A1SERPINE1KMT2ANPSR1
SCHEMBL13809648 0.86 PTPN1 (0.60) PTPN1ALDH1A1SERPINE1KMT2ANPSR1
SCHEMBL13809640 0.85 ALDH1A1 (0.50) PTPN1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL13809675 0.85 PKM (0.53) PTPN1ALDH1A1ADRB2ADRB1ADRB3
SCHEMBL13809655 0.85 POLB (0.51) PTPN1ALDH1A1SERPINE1KMT2APOLB
SCHEMBL13809646 0.84 POLB (0.52) PTPN1ALDH1A1KMT2APOLBHTT

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