SCHEMBL12904065

SCHEMBL12904065

O=C(O)CNC(=O)c1cc2occc2[nH]1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 5/20 0.62
▸ POLB P06746 2/20 0.47
▸ GAA P10253 1/20 0.44
▸ EGLN1 Q9GZT9 3/20 0.39
▸ ITGB3 P05106 1/20 0.39
▸ ITGA2B P08514 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CA12 O43570 1/20 0.37
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37

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
SCHEMBL13319926 0.87 DAO (0.56) DAOPOLBGAAALOX15KDM4E
SCHEMBL1170958 0.87 DAO (0.56) DAOPOLBGAAITGB3ITGA2B
SCHEMBL12904064 0.82 DAO (0.58) DAOPOLBGAAALOX15KDM4E
SCHEMBL13319927 0.81 DAO (0.56) DAOPOLBGAAALOX15KDM4E
SCHEMBL12904066 0.80 DAO (0.67) DAOPOLBGAAALOX15KDM4E
SCHEMBL2406834 0.78 DAO (0.65) DAOPOLBGAAALOX15
SCHEMBL679809 0.77 DAO (1.00) DAOPOLBGAAALOX15KDM4E
SCHEMBL17883341 0.77 DAO (0.62) DAOPOLBGAA
SCHEMBL1171650 0.76 DAO (0.96) DAOPOLBGAAALOX15KDM4E
SCHEMBL12880134 0.75 DAO (0.59) DAOPOLBGAAALOX15KDM4E

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
WO-2011017634-A2 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACORE INC. (US) 2011-02-10 — — WO disclosed
WO-2010017418-A1 PRODRUGS OF FUSED HETEROCYCLIC INHIBITORS OF D-AMINO ACID OXIDASE SEPRACOR INC. (US) 2010-02-11 — — WO disclosed
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