SCHEMBL28807377

SCHEMBL28807377

O=[N+]([O-])c1c(O)cc(/N=N/c2ccccc2)cc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ HSP90AA1 P07900 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.46
▸ NPC1 O15118 4/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ POLB P06746 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.44
▸ HTT P42858 1/20 0.44
▸ S100A4 P26447 1/20 0.43
▸ GPR35 Q9HC97 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CASP3 P42574 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42

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
Azobenzene SCHEMBL27927505 1.00 MEN1 (0.47) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL28807378 1.00 MEN1 (0.47) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL9258251 0.80 GPR35 (0.50) MEN1KMT2ATDP1MAPTHSP90AA1
Azobenzene SCHEMBL28234543 0.78 ALDH1A1 (0.60) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL11312732 0.77 MEN1 (0.75) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL11312734 0.77 MEN1 (0.75) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL9391661 0.77 GPR35 (0.47) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL6340091 0.77 MEN1 (0.50) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL3190322 0.77 KMT2A (0.42) MEN1KMT2ATDP1MAPTHSP90AA1
SCHEMBL6340090 0.77 MEN1 (0.50) MEN1KMT2ATDP1MAPTHSP90AA1

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
CN-103289051-B Preparation and application of optically rotating azo polyurethane thermo-optical material UNIV JIANGSU 2015-07-08 — — CN disclosed
CN-103289051-A Preparation and application of optically rotating azo polyurethane thermo-optical material UNIV JIANGSU 2013-09-11 — — CN disclosed
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