SCHEMBL6222256

SCHEMBL6222256

O=CC(=O)N(c1c(Cl)cncc1Cl)c1cn(Cc2cccc3ccccc23)c2ncccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 2/20 0.41
▸ PDE4B Q07343 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ ATM Q13315 1/20 0.38
▸ P2RX7 Q99572 2/20 0.37
▸ CNR1 P21554 2/20 0.35
▸ CNR2 P34972 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ PKM P14618 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ALDH1A1 P00352 4/20 0.34
▸ MCL1 Q07820 2/20 0.34
▸ BAD Q92934 2/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ APP P05067 1/20 0.33

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
SCHEMBL6223092 0.86 PDE4A (0.46) PDE4APDE4BPDE4CPDE4DATM
SCHEMBL6221716 0.85 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL6221877 0.84 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL6224864 0.83 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DATM
SCHEMBL6224573 0.83 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL6222086 0.81 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL6222681 0.80 PDE4A (0.37) PDE4APDE4BPDE4CPDE4DP2RX7
SCHEMBL6222412 0.80 PDE4A (0.39) PDE4APDE4BPDE4CPDE4DPTGDR2
SCHEMBL6221652 0.80 CNR1 (0.44) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL6223444 0.80 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DP2RX7

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
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
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