SCHEMBL15044927

SCHEMBL15044927

Nc1c(/N=N/c2ccccc2S(=O)(=O)c2ccccc2)cc(S(=O)(=O)O)c(N)c1/N=N/c1ccccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 3/20 0.47
▸ PHLPP2 Q6ZVD8 1/20 0.43
▸ SENP2 Q9HC62 3/20 0.43
▸ SENP1 Q9P0U3 3/20 0.43
▸ SUMO2 P61956 2/20 0.43
▸ SUMO1 P63165 2/20 0.43
▸ SENP7 Q9BQF6 2/20 0.43
▸ CCNE2 O96020 1/20 0.42
▸ CCNE1 P24864 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ SENP3 Q9H4L4 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ APP P05067 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ SNCA P37840 1/20 0.41
▸ RECQL P46063 1/20 0.41

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
SCHEMBL15044911 1.00 PTPN11 (0.47) PTPN11PHLPP2SENP2SENP1SUMO2
SCHEMBL15044775 0.91 SENP2 (0.48) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL15044776 0.91 SENP2 (0.48) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL15044909 0.91 SUMO2 (0.50) PTPN11PHLPP2SENP2SENP1SUMO2
SCHEMBL16170723 0.86 SENP2 (0.59) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170764 0.84 SENP2 (0.60) PTPN11PHLPP2SENP2SENP1SUMO2
SCHEMBL15044918 0.83 MEN1 (0.56) PTPN11PHLPP2SENP2SENP1SUMO2
SCHEMBL15044915 0.83 MEN1 (0.56) PTPN11PHLPP2SENP2SENP1SUMO2
SCHEMBL16170809 0.81 MPL (0.53) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL15044913 0.81 SENP2 (0.49) PTPN11PHLPP2SENP2SENP1SUMO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8961621-B2 Azo dyes HUNTSMAN INTERNATIONAL LLC (US) 2015-02-24 — — US disclosed
US-20140304926-A1 Azo Dyes HUNTSMAN INTERNATIONAL LLC 2014-10-16 — — US disclosed
WO-2013087400-A2 AZO DYES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2013-06-20 — — WO disclosed
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