SCHEMBL10632504

SCHEMBL10632504

CCc1[nH]c(=O)[nH]c1C(=O)c1ccnc(C#N)c1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 3/20 0.62
▸ PDE3A Q14432 3/20 0.62
▸ PDE4A P27815 17/20 0.52
▸ PDE4B Q07343 17/20 0.52
▸ PDE4C Q08493 17/20 0.52
▸ PDE4D Q08499 17/20 0.52
▸ MYC P01106 1/20 0.38

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
SCHEMBL7441027 0.81 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10635478 0.80 PDE3B (0.65) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7430782 0.79 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638580 0.79 PDE3B (0.60) PDE3BPDE3APDE4APDE4BPDE4C
Piroximone SCHEMBL119758 0.77 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638753 0.77 PDE3B (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632604 0.77 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632290 0.76 PDE3B (0.60) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632835 0.74 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632302 0.74 PDE3B (0.50) 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-0118790-B1 NOVEL AROYLIMIDAZOLONES MERRELL DOW PHARMACEUTICALS INC. (US) 1988-07-06 — — EP disclosed
US-4552880-A Aroylimidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1985-11-12 — — US disclosed
EP-0118790-A1 Novel aroylimidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1984-09-19 — — EP disclosed
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