SCHEMBL13809674

SCHEMBL13809674

COc1cc(C(=O)OCC(COC(=O)c2ccccc2)OC(=O)c2ccccc2)cc(OC)c1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.60
L3MBTL1 Q9Y468 2/20 0.52
MAPK1 P28482 1/20 0.52
SERPINE1 P05121 1/20 0.51
KMT2A Q03164 2/20 0.50
NR1I2 O75469 1/20 0.50
CHRM2 P08172 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
ADRA2B P18089 1/20 0.50
SLC6A4 P31645 1/20 0.50
OPRM1 P35372 1/20 0.50
OPRD1 P41143 1/20 0.50
OPRK1 P41145 1/20 0.50
CHRNA4 P43681 1/20 0.50
SLC6A3 Q01959 1/20 0.50
PDE4D Q08499 1/20 0.50
KCNH2 Q12809 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPT P10636 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48

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
SCHEMBL13809648 1.00 PTPN1 (0.60) PTPN1L3MBTL1MAPK1SERPINE1KMT2A
SCHEMBL2612567 0.92 PTPN1 (0.68) PTPN1MAPK1SERPINE1KMT2ASLC6A4
SCHEMBL13809637 0.87 PTPN1 (0.56) PTPN1L3MBTL1MAPK1SERPINE1KMT2A
SCHEMBL13809645 0.87 PTPN1 (0.56) PTPN1L3MBTL1MAPK1SERPINE1KMT2A
SCHEMBL13956101 0.86 PTPN1 (0.74) PTPN1SERPINE1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13809668 0.86 PTPN1 (0.49) PTPN1L3MBTL1SERPINE1KMT2AALDH1A1
SCHEMBL13809651 0.85 SERPINE1 (0.55) PTPN1SERPINE1KMT2AALDH1A1MAPT
SCHEMBL13809638 0.85 SERPINE1 (0.55) PTPN1SERPINE1KMT2AALDH1A1MAPT
SCHEMBL13809673 0.84 PTPN1 (0.47) PTPN1L3MBTL1SERPINE1KMT2AALDH1A1
SCHEMBL13809659 0.84 PKM (0.53) PTPN1L3MBTL1MAPK1SERPINE1KMT2A

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