SCHEMBL10554379

SCHEMBL10554379

CC1CC(=O)NN=C1c1ccc(N2CC(=O)NC2=O)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 17/20 0.62
▸ PDE3A Q14432 17/20 0.62
▸ PDE4A P27815 4/20 0.59
▸ PDE4B Q07343 4/20 0.59
▸ PDE4C Q08493 4/20 0.59
▸ PDE4D Q08499 4/20 0.59
▸ PDE2A O00408 1/20 0.54
▸ PDE1A P54750 1/20 0.54
▸ PDE1B Q01064 1/20 0.54
▸ PDE1C Q14123 1/20 0.54
▸ TNNC1 P63316 1/20 0.51
▸ GALR3 O60755 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ HRH3 Q9Y5N1 1/20 0.48

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
SCHEMBL10353457 0.83 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10371084 0.81 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10368593 0.80 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL16157003 0.80 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6856944 0.79 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL5681256 0.79 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL934905 0.79 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10367457 0.79 PDE3B (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL16157010 0.79 PDE3B (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL16157200 0.78 PDE3B (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4816454-A CARDIOVASCULAR DISORDERS CASSELLA AKTIENGESELLSCHAFT (DE) 1989-03-28 — — US disclosed
EP-0175363-A2 4,5-Dihydro-3(2H)-pyridazinones, process for their preparation and their use CASSELLA Aktiengesellschaft (DE) 1986-03-26 — — EP disclosed
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