SCHEMBL1543877

SCHEMBL1543877

Cc1ccc(S(=O)(=O)O[C@H]2C[C@H](CO)N(C(=O)OC(C)(C)C)C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.42
HSD11B1 P28845 1/20 0.41
MCL1 Q07820 4/20 0.40
CYP1A2 P05177 2/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
MMP13 P45452 1/20 0.39
SRC P12931 8/20 0.39
GPR119 Q8TDV5 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL1541455 1.00 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL1541453 1.00 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL29563225 1.00 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL29765023 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL12143104 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL29105266 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL12143097 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL1366650 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL1366652 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB
SCHEMBL12143096 0.91 CYP2D6 (0.42) CYP2D6HSD11B1MCL1CYP1A2POLB

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 24 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
US-8173811-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2012-05-08 US disclosed
US-8084607-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2011-12-27 US disclosed
US-20100240715-A1 Apoptosis promoters ABBOTT LABORATORIES 2010-09-23 US disclosed
US-7767684-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2010-08-03 US disclosed
US-20100022773-A1 APOPTOSIS PROMOTERS ABBVIE INC. 2010-01-28 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-7432267-B2 Fused cyclic modulators of nuclear hormone receptor function BRISTOL-MYERS SQUIBB COMAPNY (US) 2008-10-07 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
US-20070015787-A1 Apoptosis promoters ABBVIE INC. 2007-01-18 US disclosed
US-20060258657-A1 Apoptosis promoters ABBVIE INC. 2006-11-16 US 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

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

For each of this compound's patents that has machine-readable text (9 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 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
US-20130190488-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
US-20070015787-A1 Apoptosis promoters BAX, BCL2, API5 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
US-20060258657-A1 Apoptosis promoters BAX, BCL2, API5 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
US-20100022773-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
US-20050159427-A1 N-acylsulfonamide apoptosis promoters BAX, API5, CCAR2 CYP2D6 4358/4885HSD11B1 3501/4885MCL1 22/4885
US-20100240715-A1 Apoptosis promoters BAX, BCL2, API5 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
US-20140187531-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 CYP2D6 4476/4885HSD11B1 3250/4885MCL1 30/4885
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 CYP2D6 4333/4885HSD11B1 4794/4885MCL1 20/4885

“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.