SCHEMBL4725274

SCHEMBL4725274

O=P(O)(O)c1ccc(-c2nc3ncccc3[nH]2)o1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 6/20 0.47
METAP1 P53582 2/20 0.47
METAP2 P50579 1/20 0.47
HPSE Q9Y251 1/20 0.45
PRMT5 O14744 1/20 0.44
AURKA O14965 4/20 0.43
NUDT1 P36639 1/20 0.41
FBP1 P09467 2/20 0.41
FGFR1 P11362 1/20 0.41
FLT1 P17948 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL6829765 0.80 MMP2 (0.56) HPSEFBP1
SCHEMBL4725284 0.79 FBP1 (0.41) FBP1
SCHEMBL4726376 0.73 FBP1 (0.50) FBP1
SCHEMBL6830045 0.73 CBFB (0.44) FBP1
SCHEMBL1170747 0.73 METAP1 (0.72) PDE5AMETAP1METAP2HPSEPRMT5
SCHEMBL28522563 0.72 NUDT1 (0.51) PDE5AMETAP1METAP2HPSEPRMT5
SCHEMBL4796357 0.72 FBP1 (0.53) FBP1
SCHEMBL6829687 0.71 GUSB (0.49) METAP1METAP2HPSEFBP1
SCHEMBL6829684 0.71 RHEB (0.46) FBP1
SCHEMBL6829661 0.71 KDM4E (0.46) FBP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008019309-A1 NOVEL INHIBITORS OF FRUCTOSE 1,6-BISPHOSPHATASE METABASIS THERAPEUTICS, INC. (US) 2008-02-14 WO disclosed