SCHEMBL11324327

SCHEMBL11324327

CCCC(=O)OCC1CC(=O)NN=C1c1ccc2c(c1)CCC(=O)N2C

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 4/20 0.61
▸ PDE3A Q14432 4/20 0.61
▸ CYP11B1 P15538 14/20 0.41
▸ CYP11B2 P19099 13/20 0.41
▸ CYP1A2 P05177 2/20 0.39
▸ CYP17A1 P05093 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 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
SCHEMBL11316667 0.89 PDE3B (0.65) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL11328012 0.83 PDE3B (0.72) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL11333317 0.80 PDE3B (0.50) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL9718419 0.76 PDE3B (1.00) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL11326023 0.73 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11323274 0.73 PDE3B (0.55) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL11324287 0.73 PDE3B (0.57) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL11329147 0.69 PDE3B (0.80) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10810733 0.69 PDE3B (0.69) PDE3BPDE3ACYP11B1CYP11B2CYP1A2
SCHEMBL11090751 0.68 PDE3B (0.65) PDE3BPDE3ACYP11B1CYP11B2CYP1A2

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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