SCHEMBL28902179

SCHEMBL28902179

COc1ccc(NCc2coc3ccccc3c2=O)cc1O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.64
▸ MAOA P21397 4/20 0.64
▸ ADORA2B P29275 3/20 0.64
▸ CA12 O43570 4/20 0.57
▸ CA9 Q16790 4/20 0.57
▸ CA1 P00915 3/20 0.57
▸ CA2 P00918 3/20 0.57
▸ PDE10A Q9Y233 1/20 0.47
▸ NPC1 O15118 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ TUBB4A P04350 1/20 0.46
▸ TUBB P07437 1/20 0.46
▸ TUBA3C P0DPH7 1/20 0.46
▸ TUBA1B P68363 1/20 0.46
▸ TUBA4A P68366 1/20 0.46
▸ TUBB4B P68371 1/20 0.46
▸ TUBB3 Q13509 1/20 0.46
▸ TUBB2A Q13885 1/20 0.46
▸ TUBB8 Q3ZCM7 1/20 0.46

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
SCHEMBL28902182 0.81 MAOB (0.74) MAOBMAOACA12CA9CA1
SCHEMBL28902198 0.80 MAOB (0.76) MAOBMAOAADORA2BCA12CA9
SCHEMBL30787479 0.79 MAOB (0.60) MAOBMAOACA12CA9CA1
SCHEMBL4971961 0.78 MAOB (1.00) MAOBMAOAADORA2BNPC1MAPT
SCHEMBL30167102 0.77 MAOB (1.00) MAOBMAOACA12CA9CA1
SCHEMBL28902170 0.77 MAOB (1.00) MAOBMAOACA12CA9CA1
SCHEMBL30167103 0.76 MAOB (0.79) MAOBMAOAADORA2BCA12CA9
SCHEMBL28902190 0.76 MAOB (0.79) MAOBMAOAADORA2BCA12CA9
SCHEMBL30787481 0.76 MAOB (0.75) MAOBMAOACA12CA9CA1
SCHEMBL30787457 0.74 MAOB (0.76) MAOBMAOACA12CA9CA1

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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