SCHEMBL8911094

SCHEMBL8911094

O=c1[nH]c2cc(-n3ccnc3)ccc2n2c(=O)[nH]nc12

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
PDE3B Q13370 6/20 0.43
PDE3A Q14432 6/20 0.43
PDE2A O00408 2/20 0.43
CRBN Q96SW2 2/20 0.42
TBXAS1 P24557 1/20 0.42
FGFR1 P11362 1/20 0.40
FLT1 P17948 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
PDE1A P54750 1/20 0.39
PDE1B Q01064 1/20 0.39
PDE1C Q14123 1/20 0.39

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
SCHEMBL8912201 0.91 PGR (0.45) PRMT5WDR77PDE3BPDE3APDE2A
SCHEMBL8911658 0.79 CA12 (0.50)
SCHEMBL8911151 0.79 GRIK1 (0.43)
SCHEMBL8911197 0.79 CA12 (0.47)
SCHEMBL8912904 0.77 PDE3B (0.37) PRMT5WDR77PDE3BPDE3APDE2A
SCHEMBL8912360 0.77 GRIA1 (0.46)
SCHEMBL8911413 0.77 PDE2A (0.43) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL8912056 0.77 GRIA1 (0.48)
SCHEMBL8911530 0.77 GRIK1 (0.41) PDE3BPDE3APDE2APDE1APDE1B
SCHEMBL8911643 0.76 GRIK1 (0.65)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0698024-B1 [1,2,4]TRIAZOLO [4,3-a]QUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1997-01-22 EP claimed
EP-0698024-A1 1,2,4]TRIAZOLO 4,3-a]QUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1996-02-28 EP claimed
WO-1994026746-A1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1994-11-24 WO claimed
EP-0698024-B1 [1,2,4]TRIAZOLO [4,3-a]QUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1997-01-22 EP disclosed
US-5532236-A TREATMENT OF PARKINSON'S DISEASE NOVO NORDISK A/S (DK) 1996-07-02 US disclosed
EP-0698024-A1 1,2,4]TRIAZOLO 4,3-a]QUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK AS (DK) 1996-02-28 EP disclosed
WO-1994026746-A1 [1,2,4]TRIAZOLO[4,3-a]QUINOXALINE COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1994-11-24 WO disclosed