SCHEMBL13879847

SCHEMBL13879847

COc1cc(/N=N/c2cccc(P(=O)(O)O)c2)ccc1Nc1nc(O)nc(Nc2ccc(/N=N/c3cc(C)c4cc(S(=O)(=O)O)cc(S(=O)(=O)O)c4c3)c(C)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 9/20 0.51
▸ FUT8 Q9BYC5 1/20 0.35
▸ ATIC P31939 1/20 0.35
▸ SUMO2 P61956 1/20 0.35
▸ SUMO1 P63165 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP2 Q9HC62 1/20 0.35
▸ BRD4 O60885 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CHAT P28329 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ P2RY1 P47900 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CASP7 P55210 1/20 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
SCHEMBL13151899 0.97 ENPP2 (0.52) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL13151909 0.92 ENPP2 (0.49) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL13151865 0.88 ENPP2 (0.57) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL13151859 0.85 ENPP2 (0.47) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL13151869 0.84 ENPP2 (0.49) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL13151976 0.83 ENPP2 (0.46) ENPP2FUT8BRD4MEN1KMT2A
SCHEMBL13152010 0.82 ENPP2 (0.56) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL12558882 0.81 ENPP2 (0.42) ENPP2FUT8SENP2BRD4CHAT
SCHEMBL13388943 0.80 SENP2 (0.48) ENPP2FUT8ATICSUMO2SUMO1
SCHEMBL13151936 0.79 ENPP2 (0.47) ENPP2FUT8ATICSUMO2SUMO1

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-1913091-B1 AZO COMPOUNDS FUJIFILM IMAGING COLORANTS LTD (GB) 2009-04-22 — — EP disclosed
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