SCHEMBL30278269

SCHEMBL30278269

CNc1cc(OC)c(O[C@H]2CCOC2)cc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 16/20 0.51
PDE4A P27815 9/20 0.51
PDE4B Q07343 9/20 0.51
PDE4C Q08493 9/20 0.51
TYK2 P29597 3/20 0.43
JAK2 O60674 2/20 0.43
JAK1 P23458 2/20 0.43
JAK3 P52333 2/20 0.43
KAT2B Q92831 1/20 0.40
BAZ2B Q9UIF8 1/20 0.40

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
SCHEMBL24735741 1.00 PDE4D (0.51) PDE4DPDE4APDE4BPDE4CTYK2
SCHEMBL24735740 1.00 PDE4D (0.51) PDE4DPDE4APDE4BPDE4CTYK2
SCHEMBL24735738 0.89 PDE4D (0.49) PDE4DPDE4APDE4BPDE4C
SCHEMBL24735739 0.89 PDE4D (0.49) PDE4DPDE4APDE4BPDE4C
SCHEMBL30278221 0.84 PDE4D (0.54) PDE4DPDE4APDE4BPDE4CTYK2
SCHEMBL24735664 0.84 PDE4D (0.54) PDE4DPDE4APDE4BPDE4CTYK2
SCHEMBL28945888 0.83 PDE4D (0.53) PDE4DPDE4APDE4BPDE4C
SCHEMBL30278202 0.81 PDE4D (0.50) PDE4DPDE4APDE4BPDE4C
SCHEMBL24735735 0.81 PDE4D (0.50) PDE4DPDE4APDE4BPDE4C
SCHEMBL1319808 0.79 KDM4E (0.50)

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-2022258057-A1 COMPOUNDS AS ANTICANCER AGENTS JINGRUI BIOPHARMA CO., LTD. (CN) 2022-12-15 WO disclosed