SCHEMBL7580376

SCHEMBL7580376

Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cc2ccccc2cc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFKBIA P25963 2/20 0.55
▸ RELA Q04206 2/20 0.55
▸ NHERF1 O14745 1/20 0.54
▸ GUSB P08236 1/20 0.52
▸ SMN1; SMN2 Q16637 4/20 0.51
▸ L3MBTL1 Q9Y468 2/20 0.51
▸ MCL1 Q07820 1/20 0.51
▸ MAPT P10636 6/20 0.49
▸ MEN1 O00255 5/20 0.49
▸ KMT2A Q03164 5/20 0.49
▸ ALPG P10696 1/20 0.49
▸ LMNA P02545 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ SLC5A1 P13866 1/20 0.48
▸ NCOA1 Q15788 1/20 0.48
▸ NCOA3 Q9Y6Q9 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ CRHBP P24387 3/20 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
SCHEMBL7572486 0.87 NFKBIA (0.56) NFKBIARELANHERF1GUSBSMN1; SMN2
SCHEMBL15821362 0.82 L3MBTL1 (0.55) NFKBIARELANHERF1GUSBSMN1; SMN2
SCHEMBL10126623 0.78 CA12 (0.59) NHERF1SMN1; SMN2L3MBTL1MCL1MAPT
SCHEMBL3470566 0.77 SMN1; SMN2 (0.67) NFKBIARELANHERF1GUSBSMN1; SMN2
SCHEMBL29335293 0.76 NHERF1 (0.55) NFKBIARELANHERF1GUSBSMN1; SMN2
SCHEMBL15821363 0.76 CYP19A1 (0.57) NFKBIARELANHERF1SMN1; SMN2L3MBTL1
SCHEMBL11415799 0.75 NHERF1 (0.46) NFKBIARELANHERF1GUSBSMN1; SMN2
SCHEMBL10661530 0.75 CRHBP (0.71) NHERF1SMN1; SMN2L3MBTL1MAPTMEN1
SCHEMBL2241186 0.74 ALPL (0.60) NFKBIARELANHERF1GUSBSMN1; SMN2
SCHEMBL5485573 0.74 ALDH1A1 (0.62) NHERF1SMN1; SMN2L3MBTL1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 — — EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 — — WO disclosed
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