SCHEMBL7367064

SCHEMBL7367064

COc1ccc(C2CC2N)cc1OC1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.60
PDE4A P27815 7/20 0.60
PDE4C Q08493 7/20 0.60
PDE4D Q08499 7/20 0.60
KDM1A O60341 2/20 0.57

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
SCHEMBL7367066 1.00 PDE4B (0.60) PDE4BPDE4APDE4CPDE4DKDM1A
SCHEMBL6996729 0.84 KDM1A (0.72) PDE4BPDE4APDE4CPDE4DKDM1A
SCHEMBL6996727 0.84 KDM1A (0.72) PDE4BPDE4APDE4CPDE4DKDM1A
SCHEMBL7092215 0.84 KDM1A (0.72) PDE4BPDE4APDE4CPDE4DKDM1A
SCHEMBL7367513 0.82 PDE4B (0.69) PDE4BPDE4APDE4CPDE4D
SCHEMBL7367510 0.82 PDE4B (0.69) PDE4BPDE4APDE4CPDE4D
SCHEMBL7364134 0.82 PDE4B (0.66) PDE4BPDE4APDE4CPDE4D
SCHEMBL9167416 0.81 PDE4B (0.78) PDE4BPDE4APDE4CPDE4D
SCHEMBL7374911 0.81 PDE4B (0.55) PDE4BPDE4APDE4CPDE4D
SCHEMBL7365615 0.81 PDE4B (0.57) PDE4BPDE4APDE4CPDE4D

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-1994027947-A1 PHENYLCYCLOPROPANE COMPOUNDS AND THEIR USE AS cAMP AND TNF INHIBITORS RHONE-POULENC RORER LTD. (GB) 1994-12-08 WO disclosed