SCHEMBL10553122

SCHEMBL10553122

CC1CC(=O)NN=C1c1cnc(-n2ccnc2)nc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 18/20 0.69
▸ PDE3A Q14432 18/20 0.69
▸ PDE4A P27815 2/20 0.69
▸ PDE4B Q07343 2/20 0.69
▸ PDE4C Q08493 2/20 0.69
▸ PDE4D Q08499 2/20 0.69
▸ PDE2A O00408 2/20 0.50
▸ PDE1A P54750 1/20 0.43
▸ PDE1B Q01064 1/20 0.43
▸ PDE1C Q14123 1/20 0.43
▸ HRH3 Q9Y5N1 2/20 0.41
▸ TNNC1 P63316 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
SCHEMBL10469492 0.85 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
Ci-930 SCHEMBL6052113 0.81 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
Ci-930 SCHEMBL10657390 0.81 PDE3B (0.98) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10549976 0.80 PDE3B (0.68) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10646114 0.76 PDE3A (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7395148 0.76 PDE3A (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10554354 0.75 PDE3A (0.61) PDE3BPDE3APDE4APDE4BPDE4C
Ci-930 SCHEMBL10994729 0.74 PDE3B (0.83) PDE3BPDE3APDE4APDE4BPDE4C
Ci-930 SCHEMBL10994723 0.74 PDE3B (0.83) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10551547 0.73 PDE3A (0.61) 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-4847251-A CARDIOVASCULAR DISORDERS BOEHRINGER MANNHEIM GMBH (DE) 1989-07-11 — — US disclosed
EP-0255704-A2 Pyridazinone derivatives, process for their preparation and their use as medicines Roche Diagnostics GmbH (DE) 1988-02-10 — — EP disclosed
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