SCHEMBL7960159

SCHEMBL7960159

COC(=O)N1CCC(n2cc(C(=O)Nc3c(Cl)cncc3Cl)c(=O)c3cccnc32)C1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.56
KCNH2 Q12809 4/20 0.56
PDE4B Q07343 7/20 0.47
PDE4D Q08499 5/20 0.47
PDE4C Q08493 4/20 0.47
HTR6 P50406 4/20 0.40
KDM1A O60341 1/20 0.38
TYK2 P29597 2/20 0.37

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
SCHEMBL7960156 1.00 PDE4A (0.56) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960332 1.00 PDE4A (0.56) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7951799 0.95 PDE4A (0.57) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960245 0.94 PDE4A (0.58) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960298 0.93 KCNH2 (0.47) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7953511 0.93 KCNH2 (0.47) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7954854 0.93 KCNH2 (0.47) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960385 0.90 PDE4A (0.57) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960389 0.90 PDE4A (0.57) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7951741 0.89 PDE4A (0.54) PDE4AKCNH2PDE4BPDE4DPDE4C

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