SCHEMBL7340379

SCHEMBL7340379

O=C(Cc1c(Cl)cncc1Cl)c1ccc(OC(F)F)c(O[C@@H]2CC[C@H](O)C2)c1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 16/20 0.53
PDE4A P27815 17/20 0.48
PDE4B Q07343 13/20 0.48
PDE4C Q08493 13/20 0.48
ABCB11 O95342 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
SCHEMBL7333791 1.00 PDE4D (0.53) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL7333798 1.00 PDE4D (0.53) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL6863990 0.89 PDE4D (0.62) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL7334257 0.88 PDE4D (0.70) PDE4DPDE4APDE4BPDE4C
SCHEMBL7335619 0.88 PDE4D (0.70) PDE4DPDE4APDE4BPDE4C
SCHEMBL7334253 0.88 PDE4D (0.70) PDE4DPDE4APDE4BPDE4C
SCHEMBL1030283 0.85 PDE4D (0.67) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL7353130 0.85 PDE4D (0.65) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL1028814 0.82 PDE4B (0.71) PDE4DPDE4APDE4BPDE4CABCB11
SCHEMBL7353023 0.82 PDE4D (0.48) PDE4DPDE4APDE4BPDE4CABCB11

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-1996031476-A1 AROMATIC HYDROXYETHERS RHONE-POULENC RORER LIMITED (GB) 1996-10-10 WO disclosed