SCHEMBL10636277

SCHEMBL10636277

CCc1[nH]c(=O)[nH]c1C(=O)c1cc[nH]c1C#N

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 3/20 0.50
▸ PDE3A Q14432 3/20 0.50
▸ PDE4A P27815 14/20 0.47
▸ PDE4B Q07343 14/20 0.47
▸ PDE4C Q08493 14/20 0.47
▸ PDE4D Q08499 14/20 0.47
▸ ALDH1A1 P00352 2/20 0.31
▸ HPGD P15428 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ABL1 P00519 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ RIN1 Q13671 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL10632795 0.84 PDE3B (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10639055 0.78 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10995312 0.77 PDE3B (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10635854 0.76 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632604 0.75 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632511 0.74 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632648 0.74 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10998356 0.73 PDE3B (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632835 0.73 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10636312 0.72 PDE3B (0.49) 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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