SCHEMBL1539983

SCHEMBL1539983

CS(=O)(=O)c1ccc(-c2ncccc2CN2CCN(c3ccc([C]=O)cc3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.43
PTGS2 P35354 2/20 0.41
PTGS1 P23219 1/20 0.41
HTR2A P28223 4/20 0.41
TRPV1 Q8NER1 1/20 0.39
BCL2 P10415 1/20 0.38
BAK1 Q16611 1/20 0.38
HTR7 P34969 5/20 0.38
HTR6 P50406 3/20 0.38
DRD2 P14416 2/20 0.38
CYP3A4 P08684 3/20 0.38
DRD4 P21917 3/20 0.38
DRD3 P35462 2/20 0.38
MAP4K1 Q92918 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2D6 P10635 2/20 0.37
TSHR P16473 2/20 0.37
NFKB1 P19838 2/20 0.37
HIF1A Q16665 2/20 0.37
HTR1A P08908 2/20 0.37

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
SCHEMBL1540268 0.86 HTR2A (0.51) HTR2AHTR7HTR6DRD2CYP3A4
SCHEMBL1539987 0.86 GPR119 (0.43) GPR119PTGS2PTGS1HTR2ATRPV1
SCHEMBL1540118 0.85 DRD4 (0.52) HTR2ABCL2BAK1HTR7HTR6
SCHEMBL1540160 0.85 HTR2A (0.52) HTR2AHTR7DRD2DRD4DRD3
SCHEMBL1540522 0.85 DRD4 (0.54) HTR2AHTR7DRD2DRD4DRD3
SCHEMBL1540609 0.85 HTR2A (0.41) HTR2ATRPV1HTR7HTR6DRD2
SCHEMBL1541068 0.85 HTR7 (0.54) HTR2ATRPV1HTR7HTR6DRD2
SCHEMBL1540071 0.83 HTR7 (0.56) PTGS2BCL2BAK1HTR7DRD2
SCHEMBL1111852 0.80 PTGS2 (0.49) GPR119PTGS2PTGS1TRPV1HTR6
SCHEMBL6468900 0.75 DRD2 (0.40) HTR2ADRD2DRD4DRD3MAP4K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3048098-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS AbbVie Bahamas Limited (BS) 2016-07-27 EP disclosed
EP-1685119-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBVIE BAHAMAS LTD (BS) 2016-03-09 EP disclosed
US-9045444-B2 Apoptosis promoters ABBVIE INC. (US) 2015-06-02 US disclosed
US-20140187531-A1 APOPTOSIS PROMOTERS ABBVIE INC. (US) 2014-07-03 US disclosed
EP-2308812-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBVIE BAHAMAS LTD (BS) 2014-02-26 EP disclosed
US-8614318-B2 Apoptosis promoters ABBVIE INC. (US) 2013-12-24 US disclosed
US-20130190488-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2013-07-25 US disclosed
US-8354404-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2013-01-15 US disclosed
CN-1906183-B N-acylsulfonamide apoptosis promoters ABBOTT LAB 2012-06-20 CN disclosed
US-8173811-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2012-05-08 US disclosed
US-7642260-B2 N-acylsulfonamide derivatives; BCL-X1 protein inhibitors; anticarcinogenic agents; bladder cancer; for example, N-(4-(4-((4'-chloro(1,1'-biphenyl)-2-yl)methyl)piperazin-1-yl)benzoyl)-4-(((1R)-3-(dimethylamino)-1-((phenylsulfanyl)methyl)-propyl)amino)-3-nitrobenzenesulfonamide ABBOTT LABORATORIES, INC. (US) 2010-01-05 US disclosed
US-20070072860-A1 N-acylsulfonamide derivatives; BCL-X1 protein inhibitors; anticarcinogenic agents; bladder cancer; for example, N-(4-(4-((4'-chloro(1,1'-biphenyl)-2-yl)methyl)piperazin-1-yl)benzoyl)-4-(((1R)-3-(dimethylamino)-1-((phenylsulfanyl)methyl)-propyl)amino)-3-nitrobenzenesulfonamide ABBOTT LABORATORIES 2007-03-29 US disclosed
CN-1906183-A N-acylsulfonamide apoptosis promoters ABBOTT LAB (US) 2007-01-31 CN disclosed
US-20070015787-A1 Apoptosis promoters ABBVIE INC. 2007-01-18 US disclosed
US-20060258657-A1 Apoptosis promoters ABBVIE INC. 2006-11-16 US disclosed
EP-1685119-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2006-08-02 EP disclosed
US-20060128706-A1 Apoptosis promoters ABBVIE INC. 2006-06-15 US disclosed
US-20050159427-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2005-07-21 US disclosed
WO-2005049593-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2005-06-02 WO disclosed
WO-2005049594-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2005-06-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060128706-A1 Apoptosis promoters BAX, BCL2, API5 GPR119 2777/4885PTGS2 699/4885PTGS1 504/4885
US-20130190488-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 GPR119 2777/4885PTGS2 699/4885PTGS1 504/4885
US-20070015787-A1 Apoptosis promoters BAX, BCL2, API5 GPR119 2777/4885PTGS2 699/4885PTGS1 504/4885
US-20060258657-A1 Apoptosis promoters BAX, BCL2, API5 GPR119 2777/4885PTGS2 699/4885PTGS1 504/4885
US-20050159427-A1 N-acylsulfonamide apoptosis promoters BAX, API5, CCAR2 GPR119 3168/4885PTGS2 2245/4885PTGS1 2112/4885
US-20140187531-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 GPR119 2777/4885PTGS2 699/4885PTGS1 504/4885
US-20070072860-A1 N-acylsulfonamide derivatives; BCL-X1 protein inhibitors; anticarcinogenic agents; bladder cancer; for example, N-(4-(4-((4'-chloro(1,1'-biphenyl)-2-yl)methyl)piperazin-1-yl)benzoyl)-4-(((1R)-3-(dimethylamino)-1-((phenylsulfanyl)methyl)-propyl)amino)-3-nitrobenzenesulfonamide BCL2A1, BAX, BCL2L1 GPR119 3310/4885PTGS2 1733/4885PTGS1 514/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.