SCHEMBL8090935

SCHEMBL8090935

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.42
JAK3 P52333 1/20 0.36
NAMPT P43490 1/20 0.36
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RORC P51449 1/20 0.33
SSTR4 P31391 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
PDE4B Q07343 2/20 0.32
DPP4 P27487 1/20 0.32
NPC1 O15118 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
SCHEMBL8083132 0.90 NR1H2 (0.48) NR1H2JAK3NAMPTUSP2SMN1; SMN2
SCHEMBL8203269 0.83 NR1H2 (0.37) NR1H2JAK3NAMPTALDH1A1SSTR4
SCHEMBL8091894 0.81 JAK3 (0.38) NR1H2JAK3NAMPTDDB1CRBN
SCHEMBL8083216 0.81 NAMPT (0.38) NR1H2JAK3NAMPTALDH1A1MAPT
SCHEMBL8083678 0.80 NR1H2 (0.40) NR1H2JAK3NAMPTUSP2SMN1; SMN2
SCHEMBL8201202 0.78 NR1H2 (0.38) NR1H2JAK3NAMPTUSP2SMN1; SMN2
SCHEMBL30954888 0.77 NR1H2 (0.51) NR1H2NAMPTUSP2SMN1; SMN2RORC
SCHEMBL8083230 0.77 KMT2A (0.39) JAK3MEN1KMT2ASSTR4
SCHEMBL8091226 0.77 NR1H2 (0.38) NR1H2JAK3NAMPTALDH1A1MAPT
SCHEMBL8200316 0.76 NR1H2 (0.37) NR1H2JAK3NAMPTSMN1; SMN2ALDH1A1

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 9 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
US-6018054-A INTERMEDIATE COMPOUNDS FOR PREPARING NOVEL QUINOLONE AND NAPHTHYRIDONE DERIVATIVES WHICH ARE SUBSTITUTED IN THE 7-POSITION BY A PARTIALLY HYDROGENATED ISOINDOLINYL RING, USE AS ANTIBACTERIAL AGENTS AND AS FEED ADDITIVES BAYER AKTIENGESELLSCHAFT (DE) 2000-01-25 US disclosed
EP-0647644-B1 Antibacterial pyrido 1,2,3-d,e 1,3,4 benzoxacin derivatives BAYER AG (DE) 1997-11-05 EP disclosed
US-5556979-A ANIMAL FEEDS BAYER AKTIENGESELLSCHAFT (DE) 1996-09-17 US disclosed
EP-0588166-B1 Antibacterial 7-isoindolinyl-quinolone and naphthyridone derivatives BAYER AG (DE) 1996-06-05 EP disclosed
US-5508278-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-04-16 US 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