SCHEMBL6137578

SCHEMBL6137578

CC(C)(C)OC(=O)N1C(=O)C2CCCC2c2ccc(CCO[Si](C)(C)C(C)(C)C)cc21

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.33
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
USP30 Q70CQ3 1/20 0.32
ALOX5AP P20292 5/20 0.31
FEN1 P39748 5/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPT P10636 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
OPRK1 P41145 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
STS P08842 1/20 0.31

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
SCHEMBL6137535 0.95 FKBP1A (0.32) FKBP1APDE4APDE4BPDE4CPDE4D
SCHEMBL6137770 0.79 NOS3 (0.35) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL6137628 0.74 NOS3 (0.34) PDE4APDE4BPDE4CPDE4DCNR1
SCHEMBL6137592 0.74 BCHE (0.47) KDM4ELMNARAB9ASTS
SCHEMBL6069300 0.73 SMN1; SMN2 (0.37) USP30STS
SCHEMBL6137764 0.72 GPR119 (0.45) KDM4ETDP1
SCHEMBL6137343 0.72 TNKS (0.33)
SCHEMBL6137318 0.71 CDK1 (0.42) USP30
SCHEMBL6137803 0.71 ALDH1A1 (0.39) USP30LMNARAB9AMAPTNPSR1
SCHEMBL6137336 0.69 GPR119 (0.37) KDM4ELMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1129077-B9 FLUORINATED 3,4-DIHYDROQUINOLINE DERIVATIVES USED AS NOS INHIBITORS SCHERING AG (DE) 2005-07-20 EP disclosed
EP-1129077-B1 FLUORINATED 3,4-DIHYDROQUINOLINE DERIVATIVES USED AS NOS INHIBITORS SCHERING AG (DE) 2005-04-20 EP disclosed
US-6579883-B1 Nitrogen monoxide synthases; 4-amino-8-bromo-3a-fluoro-2,3,3a,9b-tetrahydro-1H-cyclopenta (c) quinoline; neurodegenerative, autoimmune, cardiovascular diseases SCHERING AKTIENGESELLSCHAFT (DE) 2003-06-17 US disclosed
EP-1129077-A1 FLUORINATED 3,4-DIHYDROQUINOLINE DERIVATIVES USED AS NOS INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2001-09-05 EP disclosed
WO-2000029381-A1 FLUORINATED 3,4-DIHYDROQUINOLINE DERIVATIVES USED AS NOS INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2000-05-25 WO disclosed