SCHEMBL9179480

SCHEMBL9179480

Cc1cc(N=Nc2ccc(N=Nc3ccc4ccc(S(=O)(=O)O)cc4c3S(=O)(=O)O)c3ccc(S(=O)(=O)O)cc23)c(C)cc1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 1/20 0.47
▸ SENP3 Q9H4L4 5/20 0.46
▸ SENP2 Q9HC62 5/20 0.46
▸ SENP1 Q9P0U3 5/20 0.46
▸ SUMO2 P61956 3/20 0.46
▸ SUMO1 P63165 3/20 0.46
▸ SENP7 Q9BQF6 3/20 0.46
▸ CYP2C9 P11712 5/20 0.46
▸ CYP2C19 P33261 4/20 0.46
▸ HSD17B10 Q99714 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.41
▸ HIF1A Q16665 3/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ ENPP2 Q13822 2/20 0.39
▸ SLC7A11 Q9UPY5 1/20 0.39
▸ CYP1A2 P05177 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ PTPRA P18433 1/20 0.39
▸ PTPRB P23467 1/20 0.39
▸ RAPGEF4 Q8WZA2 1/20 0.39

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
SCHEMBL9176573 0.88 SENP2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL10448650 0.88 SENP2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL9176345 0.88 SENP2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL9171975 0.86 PHLPP2 (0.54) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL10448347 0.86 PHLPP2 (0.54) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL9179490 0.82 SENP2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL10448646 0.82 SENP2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL9178319 0.82 SENP2 (0.47) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL9179820 0.79 SENP2 (0.51) PHLPP2SENP3SENP2SENP1SUMO2
SCHEMBL10448719 0.79 SENP2 (0.51) PHLPP2SENP3SENP2SENP1SUMO2

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
EP-0400647-B1 Polyazo dye compounds having vinylsulfone type and pyridinium type fiber reactive groups SUMITOMO CHEMICAL CO (JP) 1995-04-26 — — EP disclosed
EP-0400648-B1 Polyazo dye compounds having plural vinylsulfone type fiber reactive groups in one molecule SUMITOMO CHEMICAL CO (JP) 1994-06-08 — — EP disclosed
US-5112959-A Dyes for cellulose, polyamides and polyurethanes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-05-12 — — US disclosed
EP-0400647-A1 Polyazo dye compounds having vinylsulfone type and pyridinium type fiber reactive groups SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-12-05 — — EP disclosed
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