SCHEMBL28902178

SCHEMBL28902178

O=c1c(CNc2ccccc2F)coc2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.60
▸ MAOA P21397 1/20 0.60
▸ CA12 O43570 5/20 0.55
▸ CA9 Q16790 5/20 0.55
▸ CA2 P00918 5/20 0.55
▸ CA1 P00915 4/20 0.55
▸ KDM4C Q9H3R0 1/20 0.47
▸ CYP11B1 P15538 3/20 0.47
▸ CYP11B2 P19099 3/20 0.47
▸ CYP17A1 P05093 1/20 0.47
▸ CYP19A1 P11511 1/20 0.47
▸ HDAC1 Q13547 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ SIGMAR1 Q99720 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MITF O75030 1/20 0.42
▸ USP2 O75604 1/20 0.42

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
SCHEMBL30787461 0.83 MAOB (0.67) MAOBMAOACA12CA9CA2
SCHEMBL28902181 0.83 MAOB (0.56) MAOBMAOACA12CA9CA2
SCHEMBL28902172 0.81 MAOB (0.76) MAOBMAOACA12CA9CA2
SCHEMBL30787479 0.80 MAOB (0.60) MAOBMAOACA12CA9CA2
SCHEMBL28902190 0.80 MAOB (0.79) MAOBMAOACA12CA9CA2
SCHEMBL30167103 0.80 MAOB (0.79) MAOBMAOACA12CA9CA2
SCHEMBL28902197 0.78 MAOB (0.57) MAOBMAOACA12CA9CA2
SCHEMBL28902186 0.76 MAOB (0.70) MAOBMAOACA12CA9CA2
SCHEMBL28902167 0.76 MAOB (0.69) MAOBMAOACA12CA9CA2
SCHEMBL12655257 0.75 MAOB (0.73) MAOBMAOACA12CA9CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115246805-B Chromone-aniline alpha-glucosidase inhibitor and preparation method and application thereof 贵州医科大学 2024-01-19 — — CN disclosed
CN-115246805-A Chromone-aniline alpha-glucosidase inhibitor and preparation method and application thereof 贵州医科大学 2022-10-28 — — CN disclosed
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