SCHEMBL7616348

SCHEMBL7616348

CCCC(c1cccc(O)c1)c1c(O)cccc1P(=O)(O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 4/20 0.36
LMNA P02545 3/20 0.36
GALR3 O60755 1/20 0.36
DRD3 P35462 4/20 0.35
OPRM1 P35372 4/20 0.35
DRD2 P14416 3/20 0.35
DRD4 P21917 1/20 0.35
ADRB1 P08588 2/20 0.35
ADRA1A P35348 2/20 0.35
ADRB2 P07550 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRB3 P13945 1/20 0.35
TSHR P16473 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
NFKB1 P19838 1/20 0.35
DRD1 P21728 1/20 0.35
HTR7 P34969 1/20 0.35
ADRA1B P35368 1/20 0.35

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
SCHEMBL7621261 0.89 HIF1A (0.35) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL7621635 0.87 ESR1 (0.37) LMNADRD3OPRM1ADRA1ADRD1
SCHEMBL7620790 0.81 INPPL1 (0.37) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL7621421 0.81 HIF1A (0.37) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL6401542 0.79 SLC22A1 (0.44) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL7625108 0.78 OPRM1 (0.40) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL6402086 0.76 ADRB1 (0.44) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL6401589 0.76 HIF1A (0.40) HIF1ALMNAGALR3DRD3OPRM1
SCHEMBL7622320 0.76 ESR1 (0.39) LMNADRD3OPRM1ADRA1ATSHR
SCHEMBL7617339 0.76 RORC (0.34) HIF1ALMNAGALR3DRD3OPRM1

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