SCHEMBL710230

SCHEMBL710230

CCOc1cc(C(CN2C(=O)c3cccc(NC(=O)CCN(C)C)c3C2=O)S(C)(=O)=O)ccc1OC

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.55
PDE4C Q08493 18/20 0.55
PDE4A P27815 12/20 0.55
PDE4D Q08499 12/20 0.55
HTR2B P41595 1/20 0.55
TERT O14746 2/20 0.44

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
SCHEMBL25205204 0.89 PDE4B (0.69) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL825619 0.89 PDE4B (0.69) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL825653 0.84 PDE4B (0.53) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537157 0.83 PDE4B (0.80) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL6025567 0.82 PDE4B (0.64) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL27912279 0.81 PDE4B (0.57) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL9937865 0.81 PDE4B (0.58) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1583109 0.81 PDE4B (0.66) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL4426112 0.79 PDE4B (0.52) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL692129 0.79 PDE4B (0.47) PDE4BPDE4CPDE4APDE4DHTR2B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228071-B8 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2012-02-29 EP disclosed
EP-1228071-A4 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2002-12-04 EP disclosed
EP-1228071-A1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORPORATION (US) 2002-08-07 EP disclosed
WO-2001034606-A1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORPORATION (US) 2001-05-17 WO disclosed