SCHEMBL15564464

SCHEMBL15564464

O=c1[nH]c(=O)n(CCc2ccc(Oc3ccccc3)cc2)nc1Br.O=c1[nH]c(=O)n(CCc2ccc(Oc3ccccc3)cc2)nc1O

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DAO P14920 7/20 0.52
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA4 P48058 1/20 0.39
GRIK5 Q16478 1/20 0.39
FFAR1 O14842 1/20 0.39
FAAH O00519 1/20 0.38
MGLL Q99685 1/20 0.38
FLT1 P17948 1/20 0.37
KDR P35968 1/20 0.37
DHODH Q02127 1/20 0.36
HPGD P15428 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
SRD5A2 P31213 2/20 0.35

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
SCHEMBL16968204 0.93 DAO (0.58) DAOMEN1KMT2AGRIA1GRIA2
SCHEMBL16968265 0.93 DAO (0.58) DAOMEN1KMT2AFFAR1FAAH
SCHEMBL15564834 0.91 DAO (0.54) DAOMEN1KMT2AGRIA1GRIA2
SCHEMBL15563742 0.88 DAO (0.49) DAOKMT2AGRIA1GRIA2GRIA4
SCHEMBL15564345 0.87 DAO (0.50) DAOMEN1KMT2AGRIA1GRIA2
SCHEMBL16968253 0.83 DAO (0.61) DAOMEN1KMT2AGRIA1GRIA2
SCHEMBL15564859 0.83 DAO (0.47) DAOGRIA1GRIA2GRIA4GRIK5
SCHEMBL15565356 0.83 DAO (0.47) DAOMEN1KMT2AGRIA1GRIA2
SCHEMBL15564479 0.82 DAO (0.51) DAOKMT2AGRIA1GRIA2GRIA4
SCHEMBL15564271 0.82 DAO (0.55) DAOKMT2A

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
WO-2014025993-A1 INHIBITORS OF D-AMINO ACID OXIDASE THE JOHNS HOPKINS UNIVERSITY (US) 2014-02-13 WO disclosed