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SCHEMBL1834995

SCHEMBL1834995

CCOc1cc([C@@H](CCN(O)C=O)N2Cc3cccc(NC(C)=O)c3C2=O)ccc1OC.CCOc1cc([C@@H](CCN(O)C=O)N2Cc3cccc(NC(C)=O)c3C2=O)ccc1OC

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 17/20 0.54
▸ PDE4C Q08493 16/20 0.54
▸ PDE4A P27815 10/20 0.54
▸ PDE4D Q08499 10/20 0.54
▸ HTR2B P41595 1/20 0.52
▸ TP53 P04637 1/20 0.44
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL1822257 1.00 PDE4B (0.54) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1822251 1.00 PDE4B (0.54) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1824929 0.93 PDE4B (0.45) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1824928 0.93 PDE4B (0.45) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1825012 0.91 PDE4B (0.44) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1823551 0.87 PDE4A (0.49) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1824979 0.87 PDE4B (0.57) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL537211 0.85 PDE4B (0.59) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL694925 0.85 PDE4B (0.59) PDE4BPDE4CPDE4APDE4DHTR2B
SCHEMBL1824854 0.85 PDE4B (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606256-B1 N-ALKYL-HYDROXAMIC ACID-ISOINDOLYL COMPOUNDS AND THEIR PHARMACEUTICAL USES CELGENE CORP (US) 2011-05-04 — — EP disclosed