SCHEMBL8113261

SCHEMBL8113261

Cc1cccc([N+](=O)[O-])c1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.62
▸ LMNA P02545 2/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.62
▸ VCAM1 P19320 8/20 0.62
▸ DNMT1 P26358 1/20 0.55
▸ DNMT3A Q9Y6K1 1/20 0.55
▸ SLC25A1 P53007 1/20 0.55
▸ HTT P42858 1/20 0.51
▸ THRB P10828 1/20 0.49
▸ KDM4E B2RXH2 2/20 0.48
▸ CCR2 P41597 2/20 0.48
▸ ALDH1A1 P00352 3/20 0.47
▸ POLB P06746 1/20 0.47
▸ SLC10A2 Q12908 1/20 0.47
▸ SLC10A1 Q14973 1/20 0.47
▸ SLC10A6 Q3KNW5 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL11749307 0.84 SLC25A1 (0.68) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL11752812 0.81 VCAM1 (0.60) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL1250772 0.79 VCAM1 (0.62) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL17843852 0.78 VCAM1 (0.60) MAPTLMNAMEN1KMT2AVCAM1
SCHEMBL3619380 0.78 SLC25A1 (0.67) MAPTLMNAMEN1KMT2AVCAM1
SCHEMBL3615295 0.77 VCAM1 (0.59) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL686821 0.77 VCAM1 (1.00) MAPTLMNAVCAM1DNMT1DNMT3A
SCHEMBL3110585 0.76 VCAM1 (0.57) MAPTLMNAMEN1KMT2ANPSR1
SCHEMBL6057029 0.75 CCR2 (0.64) MAPTLMNAMEN1KMT2ADNMT1
SCHEMBL3620121 0.75 DNMT1 (0.70) MAPTLMNAMEN1KMT2AVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1091100-C N-arylsulfilimine compounds and their use as catalysts for the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 2002-09-18 — — CN disclosed
US-6114580-A N-arylsulfilimine compounds and their use as catalysts in the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 2000-09-05 — — US disclosed
EP-0888297-B1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS DOW AGROSCIENCES LLC (US) 2000-08-30 — — EP disclosed
US-5973148-A N-arylsulfilimine compounds and their use as catalysts in the preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 1999-10-26 — — US disclosed
CN-1216040-A N-arylsulfilimine compounds and their use as catalysts in preparation of N-arylarylsulfonamide compounds DOW AGROSCIENCES LLC (US) 1999-05-05 — — CN disclosed
EP-0888297-A1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS Dow AgroSciences LLC (US) 1999-01-07 — — EP disclosed
WO-1998021178-A1 N-ARYLSULFILIMINE COMPOUNDS AND THEIR USE AS CATALYSTS IN THE PREPARATION OF N-ARYLARYLSULFONAMIDE COMPOUNDS DOW AGROSCIENCES LLC (US) 1998-05-22 — — WO disclosed
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