SCHEMBL28902197

SCHEMBL28902197

CCOc1ccccc1NCc1coc2ccccc2c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 5/20 0.57
▸ MAOA P21397 1/20 0.57
▸ CA12 O43570 4/20 0.50
▸ CA9 Q16790 4/20 0.50
▸ CA2 P00918 4/20 0.50
▸ CA1 P00915 3/20 0.50
▸ MAPT P10636 3/20 0.49
▸ NPSR1 Q6W5P4 2/20 0.49
▸ RAB9A P51151 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ TP53 P04637 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ ACHE P22303 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43

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
SCHEMBL30787479 0.88 MAOB (0.60) MAOBMAOACA12CA9CA2
SCHEMBL28902187 0.87 ALDH1A1 (0.63) MAOBMAOAMAPTNPSR1RAB9A
SCHEMBL30787461 0.81 MAOB (0.67) MAOBMAOACA12CA9CA2
SCHEMBL28902192 0.81 MAOB (0.71) MAOBMAOACA12CA9CA2
SCHEMBL28902178 0.78 MAOB (0.60) MAOBMAOACA12CA9CA2
SCHEMBL28902181 0.75 MAOB (0.56) MAOBMAOACA12CA9CA2
SCHEMBL28902190 0.74 MAOB (0.79) MAOBMAOACA12CA9CA2
SCHEMBL30167103 0.74 MAOB (0.79) MAOBMAOACA12CA9CA2
SCHEMBL28902167 0.74 MAOB (0.69) MAOBMAOACA12CA9CA2
SCHEMBL12655257 0.73 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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