SCHEMBL7436887

SCHEMBL7436887

CCc1[nH]c(=O)[nH]c1C(=O)c1ccc(OC)nc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.58
▸ PDE3A Q14432 2/20 0.58
▸ PDE4A P27815 14/20 0.54
▸ PDE4B Q07343 14/20 0.54
▸ PDE4C Q08493 14/20 0.54
▸ PDE4D Q08499 14/20 0.54
▸ NNMT P40261 2/20 0.48
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 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
SCHEMBL10876859 0.80 PDE3B (0.65) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11296145 0.79 PDE3B (0.45) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638996 0.75 PDE3B (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL18228074 0.75 NNMT (0.72) NNMTMKNK1MKNK2MAPTMAOA
SCHEMBL10632760 0.75 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7434193 0.75 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
Piroximone SCHEMBL119758 0.74 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7430782 0.73 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632401 0.73 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7441027 0.73 PDE3B (0.67) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4405628-A 4-Pyridylimidazolones and method of use MERRELL DOW PHARMACEUTICALS INC. (US) 1983-09-20 — — US disclosed
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