Morpholine

Morpholine

SCHEMBL2963696

C1COCCN1.CCOc1ccccc1-n1cc(-c2ccccn2)cc(-c2ccccc2C#N)c1=O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.56
GRIA3 P42263 1/20 0.56
PDE4D Q08499 1/20 0.56
GRIN1 Q05586 2/20 0.38
GRIN2B Q13224 2/20 0.38
PDE5A O76074 2/20 0.36
PKM P14618 1/20 0.35
PIK3CD O00329 1/20 0.34
CYP3A4 P08684 1/20 0.34
AKT1 P31749 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
HIF1A Q16665 2/20 0.33
CBFB Q13951 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 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
SCHEMBL2961942 0.84 GRIA1 (0.56) GRIA1GRIA3PDE4DGRIN1GRIN2B
SCHEMBL2953916 0.82 GRIA1 (0.54) GRIA1GRIA3PDE4DGRIN1GRIN2B
SCHEMBL1882807 0.82 GRIA1 (0.69) GRIA1GRIA3PDE4D
SCHEMBL2961987 0.79 GRIA1 (0.60) GRIA1GRIA3PDE4D
SCHEMBL1884996 0.79 GRIA1 (0.79) GRIA1GRIA3PDE4DGABRA1GABRG2
SCHEMBL2963740 0.77 GRIA1 (0.58) GRIA1GRIA3PDE4DPKM
SCHEMBL30477201 0.77 GRIA1 (0.73) GRIA1GRIA3PDE4DGABRA1GABRG2
SCHEMBL1882035 0.76 GRIA1 (0.70) GRIA1GRIA3PDE4DGABRA1GABRG2
SCHEMBL14889214 0.75 GRIA1 (0.73) GRIA1GRIA3PDE4DGABRA1GABRG2
SCHEMBL1884155 0.75 GRIA1 (0.69) GRIA1GRIA3PDE4DPKMCYP3A4

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
US-7759367-B2 1,2-dihydropiridin-2-one compounds such as 3-(2-cyanophenyl)-1-phenyl-5-(2-pyridyl)-1,2-dihydropyridin-2-one, used as immunomodulators or antiinflammatory agents, and for the prevention or treatment of neurodegenerative diseases, such as demyelinating disorders EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-07-20 US disclosed
EP-1300396-B1 1,2-DIHYDROPYRIDINE COMPOUNDS, PROCESS FOR PREPARATION OF THE SAME AND USE THEREOF EISAI R&D MAN CO LTD (JP) 2009-01-14 EP disclosed
EP-1465626-B1 PHARMACEUTICAL COMPOSITIONS (KIT) COMPRISING DIHYDROPYRIDINONE COMPOUNDS AND AN IMMUNOREGULATORY (OR AN ANTIINFLAMMATORY) AGENT AND THEIR USES EISAI R&D MAN CO LTD (JP) 2008-09-03 EP disclosed