SCHEMBL7616288

SCHEMBL7616288

O=P(O)(O)Oc1ccc(O)cc1C(CCCO)c1cccc(O)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 6/20 0.34
INPP5A Q14642 4/20 0.34
INPP5B P32019 2/20 0.34
KYNU Q16719 1/20 0.33
AKT1 P31749 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
PDE3A Q14432 1/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31
POLB P06746 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
HTR1A P08908 1/20 0.30

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
SCHEMBL7621447 0.93 INPPL1 (0.36) INPPL1INPP5AINPP5BKYNUAKT1
SCHEMBL7622158 0.87 INPPL1 (0.35) INPPL1INPP5AINPP5BKYNUAKT1
SCHEMBL7615265 0.85 SLC22A1 (0.40) INPPL1INPP5AINPP5BKYNUAKT1
SCHEMBL7622196 0.77 TYR (0.41) INPPL1INPP5AINPP5BAKT1LMNA
SCHEMBL7621440 0.77 INPPL1 (0.35) INPPL1INPP5AINPP5BKYNULMNA
SCHEMBL7618825 0.75 F2 (0.39) INPPL1INPP5AINPP5BAKT1ALDH1A1
SCHEMBL7620593 0.75 SLC22A1 (0.40) INPPL1INPP5AINPP5BKYNUALDH1A1
SCHEMBL7618814 0.74 INPPL1 (0.38) INPPL1INPP5AINPP5BKYNUAKT1
SCHEMBL6396289 0.74 ADRB1 (0.42) INPPL1INPP5AINPP5BAKT1LMNA
SCHEMBL6397897 0.74 HIF1A (0.38) INPPL1INPP5AINPP5BKYNUAKT1

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