SCHEMBL10635478

SCHEMBL10635478

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

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.65
▸ PDE3A Q14432 2/20 0.65
▸ PDE4A P27815 16/20 0.54
▸ PDE4B Q07343 16/20 0.54
▸ PDE4C Q08493 16/20 0.54
▸ PDE4D Q08499 16/20 0.54
▸ KDM4E B2RXH2 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.49
▸ KDM6B O15054 1/20 0.49
▸ TET3 O43151 1/20 0.49
▸ KDM4A O75164 1/20 0.49
▸ BBOX1 O75936 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ KDM5A P29375 1/20 0.49
▸ KDM5C P41229 1/20 0.49
▸ ASPH Q12797 1/20 0.49
▸ KDM4D Q6B0I6 1/20 0.49
▸ TET2 Q6N021 1/20 0.49
▸ ALKBH5 Q6P6C2 1/20 0.49
▸ KDM7A Q6ZMT4 1/20 0.49

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
SCHEMBL10638753 0.86 PDE3B (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632290 0.85 PDE3B (0.60) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7441027 0.83 PDE3B (0.67) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7430782 0.81 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632504 0.80 PDE3B (0.62) PDE3BPDE3APDE4APDE4BPDE4C
Piroximone SCHEMBL119758 0.79 PDE3B (1.00) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638580 0.78 PDE3B (0.60) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7434015 0.78 PDE3B (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632760 0.78 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7440629 0.76 PDE3B (0.59) 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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