SCHEMBL10940511

SCHEMBL10940511

Nc1ccc2cc(S(=O)(=O)O)cc(O)c2c1/N=N/c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 4/20 0.76
▸ SUMO2 P61956 1/20 0.68
▸ SUMO1 P63165 1/20 0.68
▸ SENP7 Q9BQF6 1/20 0.68
▸ SENP2 Q9HC62 1/20 0.68
▸ APEX1 P27695 2/20 0.61
▸ CYP1A2 P05177 2/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ PHLPP2 Q6ZVD8 1/20 0.46
▸ CDK1 P06493 2/20 0.46
▸ CDK2 P24941 2/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ NPSR1 Q6W5P4 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ HSP90AA1 P07900 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ RECQL P46063 1/20 0.45

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
SCHEMBL10940519 1.00 ENPP2 (0.76) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL11765850 0.91 SUMO2 (0.81) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL11765859 0.91 SUMO2 (0.81) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL11670234 0.89 SUMO2 (0.74) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL11670202 0.87 SUMO2 (0.72) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL10941472 0.87 SUMO2 (0.72) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL10941468 0.87 SUMO2 (0.72) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL14418348 0.87 SUMO2 (0.72) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL26459720 0.87 SUMO2 (0.72) ENPP2SUMO2SUMO1SENP7SENP2
SCHEMBL3410648 0.85 APEX1 (0.77) ENPP2SUMO2SUMO1SENP7SENP2

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
EP-0070972-B1 UREYLENEBIS (HYDROXYNAPHTHALENESULFONIC ACIDS) AMERICAN CYANAMID COMPANY (US) 1985-12-11 — — EP disclosed
EP-0070972-A1 Ureylenebis (hydroxynaphthalenesulfonic acids) AMERICAN CYANAMID COMPANY (US) 1983-02-09 — — EP disclosed
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