SCHEMBL28215959

SCHEMBL28215959

O=CC(=O)c1cn(Cc2ccccc2)c2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.66
ADORA1 P30542 2/20 0.66
NPSR1 Q6W5P4 4/20 0.65
HTT P42858 3/20 0.65
CYP1A2 P05177 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2C19 P33261 1/20 0.65
CA12 O43570 1/20 0.65
CA1 P00915 1/20 0.65
CA2 P00918 1/20 0.65
CA9 Q16790 1/20 0.65
MAPK1 P28482 2/20 0.64
LMNA P02545 1/20 0.63
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
ALDH1A1 P00352 3/20 0.61
CNR2 P34972 2/20 0.61
MAPT P10636 2/20 0.61
CNR1 P21554 1/20 0.61
KDM4E B2RXH2 1/20 0.61

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
SCHEMBL27728387 0.89 POLB (0.72) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL28339249 0.87 L3MBTL1 (0.64) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL28924432 0.86 MAPT (0.52) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL27728374 0.86 CHRM1 (0.67) L3MBTL1NPSR1HTTMAPK1LMNA
SCHEMBL27707840 0.86 L3MBTL1 (0.55) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL5852445 0.84 NPSR1 (0.81) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL1606606 0.84 LMNA (0.80) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL3865315 0.83 L3MBTL1 (0.71) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL28774047 0.83 PARP1 (0.52) L3MBTL1ADORA1NPSR1HTTCYP1A2
SCHEMBL27707835 0.83 MAPT (0.65) L3MBTL1NPSR1HTTMAPK1LMNA

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
CN-108033969-B Oxoindolspirotetrahydrofuran compound and preparation method and application thereof 中国医药集团总公司四川抗菌素工业研究所 2020-04-10 CN disclosed
CN-108033969-A A kind of Oxoindole spiral shell tetrahydrofuran-compound and its preparation method and application 中国医药集团总公司四川抗菌素工业研究所 2018-05-15 CN disclosed
CN-101213174-A Oxindole compounds and their uses as therapeutic agents XENON PHARMACEUTICALS INC (CA) 2008-07-02 CN disclosed