SCHEMBL31357415

SCHEMBL31357415

OB(O)Oc1c(F)cc(F)c(-c2ccccc2)c1F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 3/20 0.33
PDE4A P27815 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
MGLL Q99685 1/20 0.31
PRKAG1 P54619 1/20 0.31
PRKAA1 Q13131 1/20 0.31
PRKAB1 Q9Y478 1/20 0.31

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
SCHEMBL29185069 0.79 PDE4B (0.36) PDE4BPDE4APDE4CPDE4DMGLL
Benzene SCHEMBL29853972 0.78 CA1 (0.30)
SCHEMBL29085630 0.77 PDE4B (0.35) PDE4BPDE4APDE4CPDE4DMGLL
SCHEMBL28318738 0.75 CYP3A4 (0.39)
Azobenzene SCHEMBL28070859 0.74 ALDH1A1 (0.38)
SCHEMBL4141751 0.74 PRKAG1 (0.32) PDE4BPDE4APDE4CPDE4DPRKAG1
SCHEMBL4126363 0.74 ACLY (0.34) PDE4BPDE4APDE4CPDE4DPRKAG1
SCHEMBL3671745 0.74 CA1 (0.32)
SCHEMBL29396896 0.74 CA1 (0.32)
SCHEMBL22655523 0.74 MGLL (0.37) MGLLPRKAG1PRKAA1PRKAB1

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
CN-111952482-B Organometallic compound and organic light emitting device including the same 三星显示有限公司 2025-01-28 CN disclosed