SCHEMBL483246

SCHEMBL483246

Nc1ccc(S(=O)(=O)N(CCO)c2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.56
RORC P51449 1/20 0.56
NR3C1 P04150 1/20 0.52
CYP2C8 P10632 2/20 0.51
CYP2C18 P33260 2/20 0.51
BACE1 P56817 1/20 0.50
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CYP2C9 P11712 1/20 0.44
TP53 P04637 1/20 0.44
BMP1 P13497 1/20 0.44
KEAP1 Q14145 1/20 0.44
NFE2L2 Q16236 1/20 0.44
ALOX5 P09917 1/20 0.44

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
SCHEMBL5461692 0.84 RORC (0.52) ESR1RORCCYP2C8CYP2C18TSHR
SCHEMBL2603075 0.81 ESR1 (0.71) ESR1RORCNR3C1CYP2C8CYP2C18
SCHEMBL11737973 0.80 ESR1 (0.67) ESR1NR3C1CYP2C8CYP2C18TSHR
SCHEMBL27789021 0.78 KMT2A (0.55) ESR1NR3C1CYP2C8CYP2C18BACE1
SCHEMBL3156533 0.77 NR3C1 (0.51) ESR1RORCNR3C1
SCHEMBL23859846 0.76 RORC (0.46) ESR1RORCKMT2A
SCHEMBL6257441 0.76 SMN1; SMN2 (0.68) CYP2C8CYP2C18BACE1TSHRCYP2C9
SCHEMBL2006245 0.76 ESR1 (0.60) ESR1TSHRMAPK1KMT2AHSD17B10
SCHEMBL2018485 0.75 RORC (0.38) RORCNR3C1CYP2C8CYP2C18BACE1
SCHEMBL5469170 0.74 PKM (0.57) RORCCYP2C18KMT2ACYP2C9

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 63 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7186753-B1 Pharmaceutical compounds NICOX S.A. (FR) 2007-03-06 US claimed
EP-1309354-A2 THERAPEUTIC POLYESTERS AND POLYAMIDES Rutgers, The State University (US) 2003-05-14 EP claimed
JP-2003515526-A 2003-05-07 JP claimed
JP-2002541233-A 2002-12-03 JP claimed
EP-1252133-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2002-10-30 EP claimed
EP-1192129-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2002-04-03 EP claimed
WO-2002009768-A2 THERAPEUTIC POLYESTERS AND POLYAMIDES RUTGERS, THE STATE UNIVERSITY (US) 2002-02-07 WO claimed
EP-1169294-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2002-01-09 EP claimed
EP-1169298-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2002-01-09 EP claimed
WO-2001012584-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2001-02-22 WO claimed
WO-2000061549-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2000-10-19 WO claimed
WO-2000061541-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2000-10-19 WO claimed
WO-2000061537-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2000-10-19 WO claimed
EP-4157357-A1 ANTIBODY-DRUG CONJUGATES Spirea Limited (GB) 2023-04-05 EP disclosed
WO-2021240155-A1 ANTIBODY-DRUG CONJUGATES SPIREA LIMITED (GB) 2021-12-02 WO disclosed
EP-3565848-A1 NITRIC OXIDE-RELEASING ALGINATES AS BIODEGRADABLE ANTIBACTERIAL SCAFFOLDS AND METHODS PERTAINING THERETO The University of North Carolina at Chapel Hill (US) 2019-11-13 EP disclosed
WO-2000061549-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2000-10-19 WO disclosed
WO-2000061541-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2000-10-19 WO disclosed
WO-2000061537-A2 PHARMACEUTICAL COMPOUNDS NICOX S.A. (FR) 2000-10-19 WO disclosed
US-4330468-A Water soluble monoazo dyes for nylon IMPERIAL CHEMICAL INDUSTRIES, LIMITED (GB) 1982-05-18 US disclosed