SCHEMBL7089586

SCHEMBL7089586

Nc1cc(S(=O)(=O)O)c2cccc(S(=O)(=O)O)c2c1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.56
AURKA O14965 1/20 0.53
AURKB Q96GD4 1/20 0.53
SUMO2 P61956 4/20 0.43
SUMO1 P63165 4/20 0.43
SENP7 Q9BQF6 4/20 0.43
SENP2 Q9HC62 4/20 0.43
SENP1 Q9P0U3 3/20 0.43
SNCA P37840 3/20 0.41
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
SENP3 Q9H4L4 1/20 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
RECQL P46063 1/20 0.41
BLM P54132 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
SCHEMBL3505111 0.88 TTR (0.53) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL3194355 0.86 AURKA (0.57) TTRAURKAAURKBSUMO2SUMO1
Hydrochloric Acid SCHEMBL5733553 0.85 AURKB (0.65) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL9465432 0.85 AURKA (0.55) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL28865539 0.85 TTR (0.54) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL1891641 0.80 SENP2 (0.58) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL31222829 0.80 SENP2 (0.58) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL159399 0.79 AURKA (0.75) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL30822934 0.79 AURKA (0.75) TTRAURKAAURKBSUMO2SUMO1
SCHEMBL4456435 0.79 SENP2 (0.56) TTRAURKAAURKBSUMO2SUMO1

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
EP-1328588-A1 METAL COMPLEX COLOURING AGENTS BASED ON BUCHERER NAPHTHOLS DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2003-07-23 EP disclosed
WO-2002033006-A1 METAL COMPLEX COLOURING AGENTS BASED ON BUCHERER NAPHTHOLS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2002-04-25 WO disclosed
EP-0304926-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1989-03-01 EP disclosed