SCHEMBL7614967

SCHEMBL7614967

O=P(O)(O)c1cccc(O)c1CC(CCO)c1cccc(O)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
KYNU Q16719 1/20 0.32
HIF1A Q16665 3/20 0.31
PGK1 P00558 2/20 0.31
PGK2 P07205 2/20 0.31
ADRB1 P08588 2/20 0.31
ADRA1A P35348 2/20 0.31
ADRB2 P07550 1/20 0.31
HTR1A P08908 1/20 0.31
ADRA2A P08913 1/20 0.31
ADRB3 P13945 1/20 0.31
TSHR P16473 1/20 0.31
ADRA2B P18089 1/20 0.31
ADRA2C P18825 1/20 0.31
NFKB1 P19838 1/20 0.31
DRD1 P21728 1/20 0.31
HTR7 P34969 1/20 0.31
ADRA1B P35368 1/20 0.31
DRD3 P35462 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL6403086 0.86 HDAC4 (0.37) POLBKYNUHIF1APGK1PGK2
SCHEMBL7615036 0.82 INPPL1 (0.36) POLBKDM4EGAAHTR2A
SCHEMBL7621621 0.81 POLB (0.32) POLBKYNUHIF1APGK1PGK2
SCHEMBL6402836 0.81 HDAC4 (0.41) POLBKYNUHIF1APGK1PGK2
SCHEMBL6395617 0.76 HDAC4 (0.40) POLBKYNUHIF1APGK1PGK2
SCHEMBL6397731 0.75 SLC22A1 (0.36) POLBKYNUHIF1AADRB1ADRA1A
SCHEMBL6396477 0.73 ESR1 (0.49) ADRA1ATSHRDRD1DRD3SLC6A3
SCHEMBL7615976 0.71 INPPL1 (0.34) POLBKYNUHIF1AADRB1ADRA1A
SCHEMBL6403761 0.69 ESR1 (0.46) ADRA1ADRD1DRD3SLC6A3LMNA
SCHEMBL6402288 0.69 HDAC4 (0.38) POLBKYNUHIF1AADRB1ADRA1A

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
EP-1175425-A2 INHIBITORS OF INTESTINAL APICAL MEMBRANE NA/PHOSPHATE CO-TRANSPORTATION THE BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2002-01-30 EP disclosed
WO-2000043402-A2 INHIBITORS OF INTESTINAL APICAL MEMBRANE NA/PHOSPHATE CO-TRANSPORTATION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-07-27 WO disclosed