SCHEMBL7963847

SCHEMBL7963847

COC1CCC(n2cc(C(=O)Nc3c(Cl)cncc3Cl)c(=O)c3cccnc32)CC1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.58
KCNH2 Q12809 6/20 0.58
PDE4B Q07343 9/20 0.48
PDE4D Q08499 8/20 0.48
PDE4C Q08493 7/20 0.48
PKM P14618 1/20 0.39
TYK2 P29597 1/20 0.38

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
SCHEMBL7963842 1.00 PDE4A (0.58) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960506 0.93 PDE4A (0.66) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7963094 0.89 PDE4A (0.62) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7954732 0.89 PDE4A (0.62) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960372 0.89 PDE4A (0.62) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7963725 0.89 PDE4A (0.64) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7961898 0.89 PDE4A (0.64) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7951799 0.89 PDE4A (0.57) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7960496 0.88 PDE4A (0.61) PDE4AKCNH2PDE4BPDE4DPDE4C
SCHEMBL7963666 0.88 PDE4A (0.55) 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