SCHEMBL6223184

SCHEMBL6223184

CC(C)Cn1cc(OC(=O)Nc2c(Cl)cncc2Cl)c2cccnc21

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 9/20 0.48
▸ PDE4B Q07343 7/20 0.48
▸ PDE4C Q08493 7/20 0.48
▸ PDE4D Q08499 7/20 0.48
▸ KCNH2 Q12809 2/20 0.46
▸ SHMT2 P34897 4/20 0.39
▸ RXFP1 Q9HBX9 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HTR3A P46098 2/20 0.35
▸ THRB P10828 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ CNR2 P34972 1/20 0.35
▸ LMNA P02545 1/20 0.35

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
SCHEMBL6220300 0.85 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL5553028 0.84 PDE4B (0.56) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL6224705 0.83 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL6223554 0.83 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL6223648 0.83 PDE4A (0.56) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL6221453 0.82 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL5553031 0.82 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL6222988 0.78 PDE4A (0.42) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL5557204 0.70 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DSHMT2
SCHEMBL5559131 0.69 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DKCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1330455-B1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME ELBION AG (DE) 2005-08-03 — — EP claimed
EP-1330455-B1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME ELBION AG (DE) 2005-08-03 — — EP disclosed
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