SCHEMBL7276709

SCHEMBL7276709

CC1CC(=O)NN=C1c1ccc(N2CCNCC2)c(N)c1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.62
PDE3B Q13370 14/20 0.59
PDE3A Q14432 14/20 0.59
GALR3 O60755 1/20 0.57
MAPT P10636 1/20 0.57
THRB P10828 1/20 0.57
PDE4A P27815 2/20 0.55
PDE4B Q07343 2/20 0.55
PDE4C Q08493 2/20 0.55
PDE4D Q08499 2/20 0.55

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
SCHEMBL7267737 0.87 PDE3B (0.78) GPR119PDE3BPDE3APDE4APDE4B
SCHEMBL7266588 0.85 GPR119 (0.59) GPR119PDE3BPDE3APDE4APDE4B
SCHEMBL7276149 0.84 PDE3B (0.55) GPR119PDE3BPDE3AGALR3MAPT
SCHEMBL7266917 0.83 GALR3 (0.66) GPR119PDE3BPDE3AGALR3MAPT
SCHEMBL992766 0.81 GALR3 (0.72) PDE3BPDE3AGALR3MAPTTHRB
SCHEMBL7267828 0.80 GPR119 (0.68) GPR119PDE3BPDE3AGALR3MAPT
SCHEMBL21225874 0.78 GALR3 (0.69) PDE3BPDE3AGALR3MAPTTHRB
SCHEMBL30100309 0.78 GALR3 (0.69) PDE3BPDE3AGALR3MAPTTHRB
SCHEMBL16157197 0.77 GALR3 (0.67) PDE3BPDE3AGALR3MAPTTHRB
SCHEMBL10519065 0.77 GPR119 (0.85) GPR119PDE3BPDE3A

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-0327800-B1 6-PHENYLDIHYDRO-3(2H)-PYRIDAZINONES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS HEUMANN PHARMA GMBH & CO (DE) 1992-05-27 EP disclosed
US-4954501-A INOTROPIC AGENTS HEUMANN PHARMA GMBH & CO. (DE) 1990-09-04 US disclosed
EP-0327800-A2 6-Phenyldihydro-3(2H)-pyridazinones, process for their preparation and medicines containing these compounds HEUMANN PHARMA GMBH & CO (DE) 1989-08-16 EP disclosed