SCHEMBL8243858

SCHEMBL8243858

CCC(C)(C)OC(=O)C1CC(Oc2ccc(Cl)c3c2C2(CCCC2)NC(=O)N3)C1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE7A Q13946 20/20 0.53
▸ PDE7B Q9NP56 3/20 0.53
▸ PDE4D Q08499 14/20 0.52
▸ PDE1A P54750 10/20 0.52
▸ PDE1B Q01064 10/20 0.52
▸ PDE1C Q14123 10/20 0.52
▸ PDE5A O76074 5/20 0.48
▸ PDE3A Q14432 4/20 0.48

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
SCHEMBL13899377 0.99 PDE7A (0.55) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3951908 0.91 PDE7A (0.56) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3950069 0.90 PDE7A (0.58) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3950067 0.90 PDE7A (0.58) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3958085 0.86 PDE7A (0.58) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3960099 0.83 PDE7A (0.59) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL13899460 0.83 PDE7A (0.62) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL298595 0.83 PDE7A (0.62) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3951868 0.82 PDE7A (0.64) PDE7APDE7BPDE4DPDE1APDE1B
SCHEMBL3949230 0.82 PDE7A (0.64) PDE7APDE7BPDE4DPDE1APDE1B

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
WO-2007063391-A2 SPIROCYCLIC QUINAZOLINE DERIVATIVES AS PDE7 INHIBITORS PFIZER LIMITED (GB) 2007-06-07 — — WO disclosed
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