SCHEMBL7911734

SCHEMBL7911734

COc1ccc(Cc2ccc(O)cc2)c(F)c1-c1cccc(Cl)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.44
PDE4B Q07343 5/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP19A1 P11511 1/20 0.39
DNMT3A Q9Y6K1 1/20 0.38
SNCA P37840 1/20 0.38
GUSB P08236 1/20 0.37
FBP1 P09467 1/20 0.36
ERN1 O75460 1/20 0.36

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
SCHEMBL7904582 0.90 PDE4D (0.41) PDE4DPDE4BSNCAGUSB
SCHEMBL4326850 0.89 TAAR1 (0.47) PDE4DPDE4BMAPTSNCA
SCHEMBL3467080 0.88 PDE4B (0.42) PDE4DPDE4BMEN1MAPTKMT2A
SCHEMBL3791461 0.88 PDE4D (0.44) PDE4DPDE4BMAPTCYP19A1SNCA
SCHEMBL8057832 0.88 PDE4D (0.49) PDE4DPDE4BMEN1MAPTKMT2A
SCHEMBL4326854 0.87 PDE4D (0.48) PDE4DPDE4BMEN1MAPTKMT2A
SCHEMBL15906153 0.87 PDE4B (0.38) PDE4DPDE4BMAPTGUSB
SCHEMBL4326556 0.86 PDE4B (0.41) PDE4DPDE4BMAPTSNCA
SCHEMBL3789377 0.86 PDE4D (0.39) PDE4DPDE4B
SCHEMBL7902765 0.86 PDE4B (0.39) PDE4DPDE4BFBP1

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-2010059838-A2 PDE4 INHIBITORS SELECTIVE FOR THE LONG FORM OF PDE4 FOR TREATING INFLAMMATION AND AVOIDING SIDE EFFECTS DECODE GENETICS EHF (IS) 2010-05-27 WO disclosed