SCHEMBL1542046

SCHEMBL1542046

CN(C)CCC[C@H](CSc1ccccc1)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]

nearest known ligand 0.89

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 16/20 0.89
BCL2 P10415 12/20 0.60
SMN1; SMN2 Q16637 1/20 0.57
BDKRB1 P46663 2/20 0.55
ALB P02768 1/20 0.54
BCL2L2 Q92843 1/20 0.54
BDKRB2 P30411 1/20 0.52
DOT1L Q8TEK3 1/20 0.52

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
SCHEMBL27671268 1.00 BCL2L1 (0.89) BCL2L1BCL2SMN1; SMN2BDKRB1ALB
SCHEMBL1541685 0.97 BCL2L1 (0.88) BCL2L1BCL2SMN1; SMN2BDKRB1ALB
SCHEMBL554723 0.94 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL29686481 0.94 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL376632 0.94 BCL2L1 (1.00) BCL2L1BCL2ALBBCL2L2
SCHEMBL4733552 0.90 BCL2L1 (0.88) BCL2L1BCL2ALBBCL2L2DOT1L
SCHEMBL2945774 0.89 BCL2L1 (0.82) BCL2L1BCL2SMN1; SMN2BDKRB1ALB
SCHEMBL2021922 0.88 BCL2L1 (0.81) BCL2L1BCL2SMN1; SMN2BDKRB1ALB
SCHEMBL4737868 0.88 BCL2L1 (0.78) BCL2L1BCL2SMN1; SMN2ALBBCL2L2
SCHEMBL4737863 0.88 BCL2L1 (0.78) BCL2L1BCL2SMN1; SMN2ALBBCL2L2

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 30 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-7504512-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-03-17 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
EP-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP disclosed
US-20050159427-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2005-07-21 US disclosed
US-20040192681-A1 N-acylsulfonamide apoptosis promoters ABBVIE INC. 2004-09-30 US disclosed
US-6720338-B2 BCL-X1 INHIBITING COMPOSITIONS AND METHODS OF PROMOTING APOPTOSIS IN A MAMMAL ABBOTT LABORATORIES 2004-04-13 US disclosed
US-20020055631-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2002-05-09 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 BCL2L1 10/4885BCL2 2/4885SMN1; SMN2 2412/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 4/4885BCL2 3/4885SMN1; SMN2 1656/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 BCL2L1 5/4885BCL2 3/4885SMN1; SMN2 1440/4885
US-20130190488-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885SMN1; SMN2 2412/4885
US-20070015787-A1 Apoptosis promoters BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885SMN1; SMN2 2412/4885
US-20060258657-A1 Apoptosis promoters BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885SMN1; SMN2 2412/4885
US-20050159427-A1 N-acylsulfonamide apoptosis promoters BAX, API5, CCAR2 BCL2L1 20/4885BCL2 4/4885SMN1; SMN2 1110/4885
US-20140187531-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 BCL2L1 10/4885BCL2 2/4885SMN1; SMN2 2412/4885
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 BCL2L1 3/4885BCL2 4/4885SMN1; SMN2 2635/4885

“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.