SCHEMBL8201202

SCHEMBL8201202

CC(C)(C)OC(=O)N1CC2C=CCC(OC(=O)O)C2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.38
RORC P51449 1/20 0.35
GPR119 Q8TDV5 1/20 0.34
USP30 Q70CQ3 1/20 0.33
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NAMPT P43490 1/20 0.33
SSTR4 P31391 1/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
JAK3 P52333 1/20 0.32
PDE4B Q07343 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL8200316 0.84 NR1H2 (0.37) NR1H2GPR119SMN1; SMN2NAMPTSSTR4
SCHEMBL8083678 0.82 NR1H2 (0.40) NR1H2RORCGPR119USP30USP2
SCHEMBL8083132 0.78 NR1H2 (0.48) NR1H2RORCUSP2SMN1; SMN2NAMPT
SCHEMBL8090935 0.78 NR1H2 (0.42) NR1H2RORCUSP2SMN1; SMN2NAMPT
SCHEMBL30954888 0.76 NR1H2 (0.51) NR1H2RORCGPR119USP2SMN1; SMN2
SCHEMBL8083194 0.74 NR1H2 (0.40) NR1H2RORCGPR119USP30USP2
SCHEMBL8203269 0.72 NR1H2 (0.37) NR1H2NAMPTSSTR4KDM4EHPGD
SCHEMBL16759817 0.72 NR1H2 (0.58) NR1H2RORCGPR119USP2SMN1; SMN2
SCHEMBL18082348 0.72 NR1H2 (0.58) NR1H2RORCGPR119USP2SMN1; SMN2
SCHEMBL8092844 0.72 JAK3 (0.39) NR1H2GPR119USP30NAMPTSSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0682030-B1 8-Amino-10(azabicycloalkyl)-pyrido[1,2,3-d,e] [1,3,4] benzoxadiazine derivatives, process for their preparation and antibacterial agents containing them BAYER AG (DE) 2000-07-05 EP disclosed
EP-0647644-B1 Antibacterial pyrido 1,2,3-d,e 1,3,4 benzoxacin derivatives BAYER AG (DE) 1997-11-05 EP disclosed
EP-0588166-B1 Antibacterial 7-isoindolinyl-quinolone and naphthyridone derivatives BAYER AG (DE) 1996-06-05 EP disclosed
EP-0682030-A1 8-Amino-10(azabicycloalkyl)-pyrido[1,2,3-d,e] [1,3,4] benzoxadiazine derivatives, process for their preparation and antibacterial agents containing them BAYER AG (DE) 1995-11-15 EP disclosed
EP-0647644-A1 Antibacterial pyrido 1,2,3-d,e 1,3,4 benzoxacin derivatives BAYER AG (DE) 1995-04-12 EP disclosed
EP-0588166-A2 Antibacterial 7-isoindolinyl-quinolone and naphthyridone derivatives BAYER AG (DE) 1994-03-23 EP disclosed