SCHEMBL10639055

SCHEMBL10639055

CCc1[nH]c(=O)[nH]c1C(=O)c1[nH]ccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 2/20 0.52
▸ PDE3A Q14432 2/20 0.52
▸ PDE4A P27815 14/20 0.49
▸ PDE4B Q07343 14/20 0.49
▸ PDE4C Q08493 14/20 0.49
▸ PDE4D Q08499 14/20 0.49
▸ DHODH Q02127 1/20 0.34
▸ NAPRT Q6XQN6 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HCAR2 Q8TDS4 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
SCHEMBL10632648 0.84 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10636277 0.78 PDE3B (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632795 0.78 PDE3B (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632760 0.76 PDE3B (0.70) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638692 0.76 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632620 0.74 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7341880 0.74 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7431281 0.74 PDE3B (0.58) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10639159 0.72 PDE3B (0.54) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7595639 0.72 KMT2A (0.41) NAPRTKDM4EGAAMAPTHCAR2

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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