SCHEMBL7467935

SCHEMBL7467935

CC1CC(=O)NN=C1c1ccc2c(c1)CNC(=O)N2C

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 18/20 0.71
PDE3A Q14432 18/20 0.71
PDE4A P27815 4/20 0.60
PDE4B Q07343 4/20 0.60
PDE4C Q08493 4/20 0.60
PDE4D Q08499 4/20 0.60

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
SCHEMBL11329147 0.84 PDE3B (0.80) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9718419 0.83 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11327213 0.78 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7414950 0.78 PDE3B (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11322663 0.77 PDE3B (0.69) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9731374 0.77 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11315739 0.76 PDE3B (0.74) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10353457 0.76 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7436236 0.75 PDE4A (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7343441 0.74 PDE3B (0.83) PDE3BPDE3APDE4APDE4BPDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0247177-A4 BENZODIAZINONE-PYRIDAZINONE AND HYDROXY-PYRAZOLYL COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES. RORER INTERNAT OVERSEAS INC (US) 1988-04-06 EP claimed
EP-0247177-A1 BENZODIAZINONE-PYRIDAZINONE AND HYDROXY-PYRAZOLYL COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES RORER INTERNATIONAL (OVERSEAS) INC. (a Delaware corporation) (US) 1987-12-02 EP claimed
WO-1987003201-A1 BENZODIAZINONE-PYRIDAZINONE AND HYDROXY-PYRAZOLYL COMPOUNDS, CARDIOTONIC COMPOSITIONS INCLUDING THE SAME, AND THEIR USES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1987-06-04 WO claimed