SCHEMBL7707992

SCHEMBL7707992

O=C(O)/C=C/c1ccc(OC(F)F)c2oc3cnccc3c12

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.43
PDE4D Q08499 2/20 0.43
PDE4A P27815 1/20 0.43
PDE4C Q08493 1/20 0.43
CCNC P24863 5/20 0.33
CDK8 P49336 5/20 0.33
CA12 O43570 2/20 0.32
CA9 Q16790 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ROCK2 O75116 1/20 0.30

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
SCHEMBL2563026 0.86 CCNC (0.40) PDE4BPDE4DPDE4APDE4CCCNC
SCHEMBL2560821 0.86 HPGD (0.41) PDE4BPDE4DPDE4APDE4CCCNC
SCHEMBL2562773 0.86 HPGD (0.41) PDE4BPDE4DPDE4APDE4CCCNC
SCHEMBL2556065 0.84 PDE4B (0.43) PDE4BPDE4DPDE4APDE4C
SCHEMBL2562731 0.83 KDM4E (0.39) CCNCCDK8MEN1KMT2ALMNA
SCHEMBL7709222 0.77 SMN1; SMN2 (0.41) PDE4BPDE4DPDE4APDE4CCCNC
SCHEMBL2562661 0.75 PDE4B (0.52) PDE4BPDE4DPDE4APDE4C
SCHEMBL2556731 0.73 CCNC (0.42) CCNCCDK8MEN1KMT2ALMNA
SCHEMBL2562008 0.73 CCNC (0.42) CCNCCDK8CA12CA9
SCHEMBL74217 0.72 PDE4B (0.63) PDE4BPDE4DPDE4APDE4CMEN1

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-2011132051-A2 TRICYCLE COMPOUNDS AS PHOSPHODIESTERASE-10 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO disclosed