SCHEMBL11326023

SCHEMBL11326023

CC(=O)OCC1CC(=O)NN=C1c1ccc2c(c1)C(C)CC(=O)N2C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 16/20 0.48
▸ PDE3A Q14432 16/20 0.48
▸ PDE4A P27815 2/20 0.43
▸ PDE4B Q07343 2/20 0.43
▸ PDE4C Q08493 2/20 0.43
▸ PDE4D Q08499 2/20 0.43
▸ GPR119 Q8TDV5 2/20 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
SCHEMBL11326531 0.86 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11316667 0.84 PDE3B (0.65) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11322663 0.81 PDE3B (0.69) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11333317 0.77 PDE3B (0.50) PDE3BPDE3AGPR119
SCHEMBL10704316 0.74 PDE3B (0.50) PDE3BPDE3AGPR119
SCHEMBL11324327 0.73 PDE3B (0.61) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10647369 0.72 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11315242 0.70 PDE3B (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11328012 0.69 PDE3B (0.72) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11328059 0.67 PDE4A (0.53) 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-4258185-A HYPOTENSIVE, ANTITHROMBOTIC AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1981-03-24 — — US disclosed
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