SCHEMBL7276546

SCHEMBL7276546

CCC(CC)c1ccc(OC)c(O[C@@H]2CC3CCC2C3)c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.58
PDE4A P27815 14/20 0.55
PDE4C Q08493 14/20 0.55
PDE4D Q08499 14/20 0.55
PDE3B Q13370 1/20 0.46
PDE3A Q14432 1/20 0.46
PDGFRB P09619 2/20 0.44
PDGFRA P16234 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
SCHEMBL7276559 1.00 PDE4B (0.58) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7270529 0.87 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7289526 0.87 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7271066 0.87 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7271064 0.87 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7270534 0.87 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7278849 0.86 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7278844 0.86 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7289537 0.86 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DPDE3B
SCHEMBL7277081 0.86 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1991007501-A1 ENZYMATIC RESOLUTION OF ENDO-BICYCLO[2.2.1]HEPTAN-2-OL AND DERIVED PHARMACEUTICAL AGENTS PFIZER INC. (US) 1991-05-30 WO claimed
EP-0428302-A2 Enzymatic resolution of endo-bicycle(2.2.1)-heptan-2-ol and derived pharmaceutical agents PFIZER INC. (US) 1991-05-22 EP claimed