SCHEMBL7960140

SCHEMBL7960140

O=C(NC1CCCC1)c1cn([C@H]2CC[C@H](O)CC2)c2ncccc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.51
PDE4A P27815 2/20 0.47
PDE4B Q07343 2/20 0.47
PDE4C Q08493 2/20 0.47
PDE4D Q08499 2/20 0.47
CNR2 P34972 8/20 0.47
CNR1 P21554 7/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL7960143 1.00 KCNH2 (0.51) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7963664 0.96 KCNH2 (0.55) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7963667 0.96 KCNH2 (0.55) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7963122 0.83 KDM4E (0.51) KCNH2PDE4A
SCHEMBL7963124 0.83 KDM4E (0.51) KCNH2PDE4A
SCHEMBL7960552 0.83 PDE4A (0.48) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7960556 0.83 PDE4A (0.48) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7966298 0.82 CNR1 (0.48) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7962005 0.82 CNR1 (0.48) KCNH2PDE4APDE4BPDE4CPDE4D
SCHEMBL7960294 0.82 CNR1 (0.48) KCNH2PDE4APDE4BPDE4CPDE4D

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
US-6331548-B1 PREVENTION OR TREATMENT OF CYTOKINE RELATED DISEASES SUNTORY LIMITED (JP) 2001-12-18 US disclosed
EP-0978516-A1 1-CYCLOALKYL-1,8-NAPHTHYRIDIN-4-ONE DERIVATIVES WITH PHOSPHODIESTERASE IV INHIBITORY ACTIVITY SUNTORY LIMITED (JP) 2000-02-09 EP disclosed