SCHEMBL11404435

SCHEMBL11404435

Nc1c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c2c1/N=N/c1cc(Nc2nc(Cl)nc(Cl)n2)c(S(=O)(=O)O)cc1S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.51
▸ PRMT1 Q99873 2/20 0.48
▸ CYP1A2 P05177 2/20 0.46
▸ ENPP2 Q13822 5/20 0.43
▸ MAPK1 P28482 2/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ DNASE1L3 Q13609 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ THRB P10828 1/20 0.40
▸ CHAT P28329 3/20 0.39
▸ ENPP3 O14638 1/20 0.39
▸ ENPP1 P22413 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ NT5E P21589 1/20 0.37
▸ SUMO2 P61956 1/20 0.36
▸ SUMO1 P63165 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36

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
SCHEMBL11404442 1.00 FUT8 (0.51) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL14038348 0.86 FUT8 (0.57) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL12189775 0.85 FUT8 (0.60) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL16330376 0.81 FUT8 (0.52) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL12974385 0.81 FUT8 (0.51) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL11404897 0.80 CYP1A2 (0.58) PRMT1CYP1A2ENPP2MAPK1CYP2C9
SCHEMBL9116929 0.79 FUT8 (0.59) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL9343981 0.79 FUT8 (0.59) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL14314573 0.79 FUT8 (0.54) FUT8PRMT1CYP1A2ENPP2MAPK1
SCHEMBL14038346 0.77 FUT8 (0.49) FUT8PRMT1CYP1A2ENPP2MAPK1

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
US-4191687-A Reactive dyestuffs containing the residue of 1-hydroxy-7-amino-8-(5'-amino-2',4'-disulphophenylazo)naphthalene-3,6-disulphonic acid IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-03-04 — — US disclosed
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