SCHEMBL7572486

SCHEMBL7572486

Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NFKBIA P25963 4/20 0.56
▸ RELA Q04206 4/20 0.56
▸ GUSB P08236 1/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ NHERF1 O14745 1/20 0.50
▸ RECQL P46063 1/20 0.48
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ MAPT P10636 4/20 0.47
▸ LMNA P02545 2/20 0.47
▸ HTT P42858 2/20 0.47
▸ SLC5A1 P13866 1/20 0.47
▸ NCOA1 Q15788 1/20 0.47
▸ NCOA3 Q9Y6Q9 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ MAP1LC3B Q9GZQ8 1/20 0.47
▸ MAPK1 P28482 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
SCHEMBL7580376 0.87 NFKBIA (0.55) NFKBIARELAGUSBSMN1; SMN2NHERF1
SCHEMBL163325 0.80 RECQL (0.69) NFKBIARELASMN1; SMN2RECQLMEN1
SCHEMBL7572360 0.78 KDM4E (0.59) RECQLMEN1KMT2AMAPTLMNA
SCHEMBL10825800 0.76 CRHBP (0.65) NFKBIARELAGUSBNHERF1MEN1
SCHEMBL3470566 0.76 SMN1; SMN2 (0.67) NFKBIARELAGUSBSMN1; SMN2NHERF1
SCHEMBL15821362 0.76 L3MBTL1 (0.55) NFKBIARELAGUSBSMN1; SMN2NHERF1
SCHEMBL10126623 0.74 CA12 (0.59) SMN1; SMN2NHERF1MAPTLMNAALDH1A1
SCHEMBL2098718 0.73 RECQL (0.55) NFKBIARELARECQLMEN1KMT2A
SCHEMBL2241186 0.73 ALPL (0.60) NFKBIARELAGUSBSMN1; SMN2NHERF1
SCHEMBL23832700 0.72 TSHR (0.58) NFKBIARELAGUSBSMN1; SMN2NHERF1

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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