SCHEMBL6224563

SCHEMBL6224563

Cc1c(N(C(=O)C=O)c2cn(Cc3ccc(F)cc3)c3ncccc23)c(=O)n(C)c(=O)n1C

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 4/20 0.42
▸ CNR1 P21554 2/20 0.42
▸ PDE4A P27815 1/20 0.42
▸ PDE4B Q07343 1/20 0.42
▸ PDE4C Q08493 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ RXFP1 Q9HBX9 2/20 0.39
▸ HTR6 P50406 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ FSCN1 Q16658 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ KAT2B Q92831 1/20 0.36
▸ HPGD P15428 1/20 0.35
▸ NPSR1 Q6W5P4 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
SCHEMBL6222614 0.88 CNR2 (0.41) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6224508 0.82 CNR2 (0.42) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6224864 0.82 PDE4A (0.57) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6222754 0.80 PDE4A (0.49) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6223621 0.78 TP53 (0.45) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6226018 0.77 TSHR (0.43) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6222292 0.77 PDE4A (0.44) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6225092 0.76 PDE4A (0.42) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6221652 0.76 CNR1 (0.44) CNR2CNR1PDE4APDE4BPDE4C
SCHEMBL6221716 0.75 PDE4A (0.47) CNR2CNR1PDE4APDE4BPDE4C

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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