SCHEMBL27758741

SCHEMBL27758741

O=C(O)c1cc2sc(C=Cc3ccccc3)cc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 4/20 0.46
▸ KDM4E B2RXH2 4/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ HPGD P15428 3/20 0.44
▸ SRD5A2 P31213 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ ALDH1A1 P00352 4/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ GRIN2D O15399 1/20 0.41
▸ GRIN3B O60391 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ AHR P35869 1/20 0.41
▸ CHRNA7 P36544 1/20 0.41
▸ GRIN1 Q05586 1/20 0.41
▸ GRIN2A Q12879 1/20 0.41

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
SCHEMBL6623887 0.79 DAO (0.50) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL27780125 0.77 DAO (0.45) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL69502 0.73 DAO (0.51) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL27779792 0.70 DAO (0.49) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL4393058 0.70 DAO (0.47) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL1244830 0.69 DAO (0.48) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL1244120 0.68 HRH4 (0.56) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL1243913 0.68 DAO (0.53) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL1244150 0.68 DAO (0.53) DAOKDM4EHSD17B10HPGDSRD5A2
SCHEMBL1244709 0.68 DAO (0.53) DAOKDM4EHSD17B10HPGDSRD5A2

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-101511832-A Fused heterocyclic inhibitors of D-amino acid oxidase SEPRACOR INC (US) 2009-08-19 — — CN disclosed
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