SCHEMBL6992446

SCHEMBL6992446

CC(O)C(CCCc1ccccc1)n1ncc(OC(N)=O)c1N

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
LPAR1 Q92633 2/20 0.37
PDE4A P27815 3/20 0.37
PDE4B Q07343 3/20 0.37
PDE4C Q08493 3/20 0.37
PDE4D Q08499 3/20 0.37
FAAH O00519 2/20 0.36
GRIK1 P39086 1/20 0.34

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
SCHEMBL6996007 0.88 PDE4A (0.41) LMNALPAR1PDE4APDE4BPDE4C
SCHEMBL7885859 0.84 RIPK2 (0.43) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL7510987 0.82 LMNA (0.39) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL7381725 0.80 PDE4A (0.39) LPAR1PDE4APDE4BPDE4CPDE4D
SCHEMBL6995428 0.80 DRD2 (0.38) LMNALPAR1PDE4APDE4BPDE4C
SCHEMBL6993975 0.78 LMNA (0.36) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL6998949 0.77 FAAH (0.38) LMNAFAAH
SCHEMBL7851968 0.76 DAGLA (0.37) PDE4APDE4BPDE4CPDE4DGRIK1
SCHEMBL7355527 0.75 MEN1 (0.43) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL7885863 0.74 MEN1 (0.42) LPAR1PDE4APDE4BPDE4CPDE4D

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0973774-B1 1,5-DIHYDRO-PYRAZOLO 3,4-D]-PYRIMIDINONE DERIVATIVES BAYER AG (DE) 2003-01-22 EP disclosed
EP-0973774-A1 1,5-DIHYDRO-PYRAZOLO 3,4-D]-PYRIMIDINONE DERIVATIVES BAYER AG (DE) 2000-01-26 EP disclosed
WO-1998040384-A1 1,5-DIHYDRO-PYRAZOLO[3,4-D]-PYRIMIDINONE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1998-09-17 WO disclosed