SCHEMBL7407493

SCHEMBL7407493

COc1ccc(-c2ccc(O)c(C=O)c2)cc1OCC1CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 9/20 0.53
PDE4B Q07343 9/20 0.52
PDE4A P27815 3/20 0.52
PDE4C Q08493 3/20 0.52
PDE4D Q08499 3/20 0.52
FPR2 P25090 1/20 0.48

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
SCHEMBL30855489 0.83 ERN1 (0.74) ERN1
SCHEMBL14091645 0.83 ERN1 (0.74) ERN1
SCHEMBL6644961 0.78 ERN1 (0.62) ERN1
SCHEMBL5796324 0.77 ALDH1A1 (0.49) ERN1PDE4BPDE4APDE4CPDE4D
SCHEMBL30352601 0.76 ALDH1A1 (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL498127 0.76 ALDH1A1 (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL7411191 0.76 PDE4B (0.63) PDE4BPDE4APDE4CPDE4DFPR2
SCHEMBL6639272 0.73 ERN1 (0.74) ERN1
SCHEMBL24254372 0.73 ERN1 (0.60) ERN1PDE4BPDE4APDE4CPDE4D
SCHEMBL20456502 0.73 ERN1 (0.42) ERN1PDE4BPDE4APDE4CPDE4D

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-1995027692-A1 SUBTITUTED BIPHENYL TNF INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1995-10-19 WO disclosed