SCHEMBL6993975

SCHEMBL6993975

CCc1nn(C(CCCc2ccccc2)C(C)O)c(N)c1OC(N)=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
PDE2A O00408 3/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 1/20 0.33
FAAH O00519 4/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GRIK1 P39086 1/20 0.33

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
SCHEMBL7383720 0.93 FAAH (0.33) FAAHSMN1; SMN2GRIK1
SCHEMBL6997649 0.89 LMNA (0.38) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL6995428 0.88 DRD2 (0.38) LMNAPDE2APDE4APDE4BPDE4C
SCHEMBL7895726 0.85 PDE2A (0.41) PDE2APDE4APDE4BPDE4CPDE4D
SCHEMBL7001343 0.80 SMN1; SMN2 (0.35) LMNASMN1; SMN2
SCHEMBL7510987 0.79 LMNA (0.39) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL6992446 0.78 LMNA (0.38) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL7885863 0.76 MEN1 (0.42) PDE2APDE4APDE4BPDE4CPDE4D
SCHEMBL7409812 0.74 PDE2A (0.36) PDE2AGRIK1
SCHEMBL7851968 0.74 DAGLA (0.37) PDE4APDE4BPDE4CPDE4DSMN1; SMN2

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