SCHEMBL30956090

SCHEMBL30956090

COc1ccc(NCc2coc3ccccc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 4/20 0.59
▸ MAOA P21397 1/20 0.59
▸ GAA P10253 4/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ CA2 P00918 3/20 0.51
▸ CA12 O43570 2/20 0.51
▸ CA1 P00915 2/20 0.51
▸ CA9 Q16790 2/20 0.51
▸ MAPT P10636 5/20 0.50
▸ PSMB5 P28074 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ HIF1A Q16665 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ ALOX12 P18054 1/20 0.49
▸ PHLPP2 Q6ZVD8 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ CNR2 P34972 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ KDM4E B2RXH2 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 0.91 MAOB (0.74) MAOBMAOAGAAMEN1KMT2A
SCHEMBL11729224 0.79 MAOB (0.79) MAOBCA2MAPTPSMB5
SCHEMBL30003353 0.79 LMNA (0.52) MAOBMAOAGAAMEN1KMT2A
SCHEMBL30787472 0.78 MAOB (0.60) MAOBMAOAKMT2ACA2CA12
SCHEMBL28902192 0.78 MAOB (0.71) MAOBMAOAGAAMEN1KMT2A
SCHEMBL31744579 0.77 PSMB5 (0.49) MAOBMAOACA2CA12CA1
SCHEMBL30956086 0.75 MAOB (0.54) MAOBMAOACA2MAPTPSMB5
SCHEMBL30167102 0.74 MAOB (1.00) MAOBMAOACA2CA12CA1
SCHEMBL28902170 0.74 MAOB (1.00) MAOBMAOACA2CA12CA1
SCHEMBL30787489 0.74 MAOB (0.66) MAOBMAOAMEN1KMT2ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118005692-A Preparation of benzofuran derivative by initiating free radical reaction by superelectron donor with heteroatom as center and application 贵州大学 2024-05-10 — — CN disclosed
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