SCHEMBL28033753

SCHEMBL28033753

COC(=O)c1ccc(OCC2CC2)c(OCC2CC2)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 19/20 0.59
PDE4A P27815 7/20 0.59
PDE4C Q08493 7/20 0.59
PDE4D Q08499 7/20 0.59
MAPT P10636 1/20 0.49

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
SCHEMBL28033773 0.94 PDE4B (0.55) PDE4BPDE4APDE4CPDE4D
SCHEMBL4278555 0.94 PDE4B (0.63) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL2090601 0.94 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL28033787 0.90 PDE4B (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL23047404 0.89 PDE4B (0.56) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL2803310 0.89 PDE4B (0.55) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL17050365 0.88 NOTUM (0.50) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL15650723 0.88 CA12 (0.53) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL29790148 0.88 NOTUM (0.50) PDE4BPDE4APDE4CPDE4DMAPT
SCHEMBL30362197 0.88 CA12 (0.53) PDE4BPDE4APDE4CPDE4DMAPT

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
CN-105085429-A Heteroaromatic derivative and application thereof to medicament GUANGDONG HEC PHARMACEUTICAL 2015-11-25 CN disclosed