SCHEMBL17167121

SCHEMBL17167121

Cc1ccc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(C)cc4)cc3)c3ccc(/C=C/c4cccc(B5CC(C)(C)C(C)(C)O5)c4)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 4/20 0.40
APP P05067 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
RELA Q04206 2/20 0.32

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
SCHEMBL13636793 0.82 NFE2L2 (0.42) NFE2L2APPKDM4EHPGDRELA
SCHEMBL13636790 0.76 LIPG (0.45) NFE2L2APPRELA
SCHEMBL7955740 0.75 TP53 (0.39)
SCHEMBL20832231 0.74
SCHEMBL4402172 0.74 NFE2L2 (0.59) NFE2L2APPRELA
SCHEMBL13636792 0.71 LPL (0.44) NFE2L2APPRELA
SCHEMBL14526441 0.71 NFE2L2 (0.56) NFE2L2APPRELA
SCHEMBL19863795 0.71 RELA (0.57) NFE2L2APPKDM4EHPGDRELA
SCHEMBL9395031 0.71 NFE2L2 (0.56) NFE2L2APPRELA
SCHEMBL9395024 0.71 NFE2L2 (0.56) NFE2L2APPRELA

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
EP-1957603-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-10-14 EP disclosed