SCHEMBL10389254

SCHEMBL10389254

O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc3c(S(=O)(=O)O)cccc3c2S(=O)(=O)O)ccc1Cl

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DNMT1 P26358 1/20 0.60
▸ DNMT3A Q9Y6K1 1/20 0.60
▸ SLC25A1 P53007 1/20 0.54
▸ SLC10A2 Q12908 1/20 0.50
▸ SLC10A1 Q14973 1/20 0.50
▸ SLC10A6 Q3KNW5 1/20 0.50
▸ VCAM1 P19320 5/20 0.48
▸ LMNA P02545 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ CRHBP P24387 3/20 0.42
▸ CRHR2 Q13324 3/20 0.42
▸ THRB P10828 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ CCR2 P41597 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ HSPD1 P10809 2/20 0.41
▸ PTPN2 P17706 2/20 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
SCHEMBL10388603 0.78 DNMT1 (0.59) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL17927205 0.75 DNMT1 (1.00) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL29928232 0.75 DNMT1 (1.00) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL11294575 0.75 TTR (0.47) DNMT1MEN1MAPTKMT2ACASP6
SCHEMBL3620121 0.75 DNMT1 (0.70) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL10389335 0.73 SLC25A1 (0.75) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL11749307 0.73 SLC25A1 (0.68) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL31404890 0.73 DNMT1 (0.67) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL3615295 0.72 VCAM1 (0.59) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1
SCHEMBL10388966 0.72 POLB (0.59) DNMT1DNMT3ASLC25A1SLC10A2SLC10A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4918183-A Monoazo dyes, process for their preparation, and the use thereof CIBA-GEIGY CORPORATION (US) 1990-04-17 — — US disclosed
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