SCHEMBL8634455

SCHEMBL8634455

Cc1ccc(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)c2cccc(S(=O)(=O)O)c2C3=O)cc1CN

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNG2 P59768 5/20 0.59
GNB1 P62873 5/20 0.59
P2RY4 P51582 11/20 0.57
PHLPP2 Q6ZVD8 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
ALOX15 P16050 2/20 0.56
HSD17B10 Q99714 2/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP3A4 P08684 1/20 0.56
HPGD P15428 1/20 0.56
MAPK1 P28482 1/20 0.56
CYP2C19 P33261 1/20 0.56
HIF1A Q16665 1/20 0.56
MET P08581 1/20 0.53
P2RY2 P41231 6/20 0.53
P2RY12 Q9H244 4/20 0.53
P2RY6 Q15077 3/20 0.53
P2RY1 P47900 2/20 0.53
HPGDS O60760 1/20 0.50

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
SCHEMBL11680736 0.84 GNG2 (0.56) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL8645343 0.83 GNG2 (0.65) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL8642125 0.83 GNG2 (0.82) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL8634573 0.83 GNG2 (0.49) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL8640965 0.82 GNG2 (0.85) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL8630420 0.81 GNG2 (0.66) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL9136312 0.81 GNG2 (0.75) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL8639913 0.81 GNG2 (0.53) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL11443152 0.80 GNG2 (0.73) GNG2GNB1P2RY4PHLPP2CYP1A2
SCHEMBL11311937 0.80 PHLPP2 (0.82) GNG2GNB1P2RY4PHLPP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0602550-B1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffes DYSTAR TEXTILFARBEN GMBH & CO (DE) 1998-08-19 EP disclosed
EP-0601416-B1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 1998-07-15 EP disclosed
US-5498713-A FIBER-REACTIVE DYES HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-12 US disclosed
US-5430147-A Water-soluble anthraquinone compounds, preparation thereof, and use thereof as dyes HOECHST AG (DE) 1995-07-04 US disclosed
EP-0602550-A1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffes HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-22 EP disclosed
EP-0601416-A1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-15 EP disclosed