SCHEMBL4665298

SCHEMBL4665298

Nc1c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)cc(O)c2c1N=Nc1ccc(Nc2ncncn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 7/20 0.47
▸ PRMT1 Q99873 1/20 0.47
▸ CYP1A2 P05177 3/20 0.46
▸ SUMO2 P61956 1/20 0.45
▸ SUMO1 P63165 1/20 0.45
▸ SENP7 Q9BQF6 1/20 0.45
▸ SENP2 Q9HC62 1/20 0.45
▸ FUT8 Q9BYC5 1/20 0.44
▸ PHLPP2 Q6ZVD8 1/20 0.43
▸ CYP2C9 P11712 2/20 0.41
▸ MAPK1 P28482 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
▸ HTT P42858 1/20 0.38
▸ CD40 P25942 1/20 0.38
▸ CD40LG P29965 1/20 0.38
▸ NT5E P21589 1/20 0.38

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
SCHEMBL4665294 0.90 ENPP2 (0.44) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL4665289 0.90 ENPP2 (0.44) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL14314573 0.85 FUT8 (0.54) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL13823301 0.82 FUT8 (0.53) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL14314578 0.79 FUT8 (0.52) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL14038348 0.76 FUT8 (0.57) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL6561413 0.74 ENPP2 (0.64) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL8829835 0.74 ENPP2 (0.64) ENPP2PRMT1CYP1A2SUMO2SUMO1
SCHEMBL14314337 0.74 FUT8 (0.47) ENPP2PRMT1CYP1A2FUT8PHLPP2
SCHEMBL14269776 0.74 ENPP2 (0.60) ENPP2PRMT1CYP1A2SUMO2SUMO1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080233289-A1 diazo dyes used as ink jet printing inks or for dyeing nitrogen-containing or hydroxy-group-containing organic substrates such as leather, fibers, natural or synthetic polyamides, regenerated cellulose or textiles such as cotton; colorfastness CLARIANT FINANCE (BVI) LIMITED (VG) 2008-09-25 — — US disclosed
EP-1675912-A1 DYES COMPRISING ¬(4-¬2-AMINO-3,6-DISULPHO-8-HYDROXYNAPHTH-1-YLAZO|ANILINO)-1,3,5-TRIAZINYL| MOIETIES Clariant Finance (BVI) Limited (VG) 2006-07-05 — — EP disclosed
WO-2005028563-A1 DYES COMPRISING [(4-[2-AMINO-3,6-DISULPHO-8-HYDROXYNAPHTH-1-YLAZO]ANILINO)-1,3,5-TRIAZINYL] MOITIES CLARIANT INTERNATIONAL LTD (CH) 2005-03-31 — — WO disclosed
WO-2005028563-A1 DYES COMPRISING [(4-[2-AMINO-3,6-DISULPHO-8-HYDROXYNAPHTH-1-YLAZO]ANILINO)-1,3,5-TRIAZINYL] MOITIES CLARIANT INTERNATIONAL LTD (CH) 2005-03-31 — — WO disclosed
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