SCHEMBL4547691

SCHEMBL4547691

CC(=O)NS(=O)(=O)c1c(C)cc(C)c(C)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
DHFR P00374 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 2/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
FABP4 P15090 1/20 0.40
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39

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
SCHEMBL9176627 0.81 CA1 (0.62) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL13287262 0.80 SMN1; SMN2 (0.44) SMN1; SMN2DHFRTSHRTDP1KDM4E
SCHEMBL4547692 0.80 SMN1; SMN2 (0.47) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL11942109 0.74 KDM4E (0.40) SMN1; SMN2KDM4ELMNACA1CA2
SCHEMBL4547695 0.74 ALDH1A1 (0.36) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL4547697 0.73 ALDH1A1 (0.35) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL4547694 0.73 ALDH1A1 (0.35) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL4547696 0.73 TDP1 (0.44) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL4547693 0.73 KMT2A (0.42) SMN1; SMN2DHFRTSHRTDP1PKM
SCHEMBL83875 0.71 LMNA (0.39) SMN1; SMN2TDP1KDM4ELMNACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170096424-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2017-04-06 US disclosed
US-9403822-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2016-08-02 US disclosed
US-20160175316-A1 METHOD OF PREVENTING OR TREATING ORGAN, HEMATOPOIETIC STEM CELL OR BONE MARROW TRANSPLANT REJECTION ABBVIE INC (US) 2016-06-23 US disclosed
US-9315488-B2 Bcl-2-selective apoptosis-inducing agents for the treatment of cancer and immune diseases ABBVIE INC. (US) 2016-04-19 US disclosed
US-20160101109-A1 METHOD OF TREATING ARTHRITIS ABBVIE INC. 2016-04-14 US disclosed
US-20160009687-A1 BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES ABBVIE INC (US) 2016-01-14 US disclosed
US-9125913-B2 Bcl-2-selective apoptosis-inducing agents for the treatment of cancer and immune diseases ABBVIE INC. (US) 2015-09-08 US disclosed
US-20150246914-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2015-09-03 US disclosed
US-9073855-B2 BCL-2 selective apoptosis-inducing agents for the treatment of cancer and immune diseases ABBVIE INC. (US) 2015-07-07 US disclosed
US-9072748-B2 BCL-2-selective apoptosis-inducing agents for the treatment of cancer and immune diseases ABBVIE INC. (US) 2015-07-07 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-20090176785-A1 METHOD OF TREATING ARTHRITIS ABBOTT LABORATORIES (US) 2009-07-09 US disclosed
US-20080287419-A1 APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2008-11-20 US disclosed
US-20080182845-A1 METHOD OF PREVENTING OR TREATING ORGAN, HEMATOPOIETIC STEM CELL OR BONE MARROW TRANSPLANT REJECTION ABBOTT LABORATORIES (US) 2008-07-31 US disclosed
US-7390799-B2 Apoptosis promoters ABBOTT LABORATORIES (US) 2008-06-24 US disclosed
US-20080076779-A1 Reducing platelets in mammals blood and preventing/treating pro-thrombotic conditions and diseases via inhibitors of anti-apoptotic Bcl-2 family protein members ABBVIE INC. 2008-03-27 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-20070027135-A1 N-acylsulfonamides; BCL-X1 protein inhibitors; anticarcinogenic agents; bladder cancer; N-(4-(4-((2-(4-chlorophenyl)-5,5-dimethyl-1-cyclohex-1-en-1-yl)methyl)piperazin-1-yl)benzoyl)-4-(((1R)-3-(morpholin-4-yl)-1-((phenylsulfanyl)methyl)propyl)amino)-3-((trifluoromethyl)sulfonyl)benzenesulfonamide ABBVIE INC. 2007-02-01 US disclosed
US-20070015787-A1 Apoptosis promoters ABBVIE INC. 2007-01-18 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 (13 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-20070015787-A1 Apoptosis promoters BAX, BCL2, API5 SMN1; SMN2 2412/4885DHFR 645/4885TSHR 4124/4885
US-20150246914-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 SMN1; SMN2 2848/4885DHFR 1855/4885TSHR 3724/4885
US-20160101109-A1 METHOD OF TREATING ARTHRITIS MMP1, COL2A1, MMP13 SMN1; SMN2 2333/4885DHFR 129/4885TSHR 2198/4885
US-20100022773-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 SMN1; SMN2 2412/4885DHFR 645/4885TSHR 4124/4885
US-20080287419-A1 APOPTOSIS PROMOTERS BAX, API5, BCL2 SMN1; SMN2 1010/4885DHFR 510/4885TSHR 4175/4885
US-20070027135-A1 N-acylsulfonamides; BCL-X1 protein inhibitors; anticarcinogenic agents; bladder cancer; N-(4-(4-((2-(4-chlorophenyl)-5,5-dimethyl-1-cyclohex-1-en-1-yl)methyl)piperazin-1-yl)benzoyl)-4-(((1R)-3-(morpholin-4-yl)-1-((phenylsulfanyl)methyl)propyl)amino)-3-((trifluoromethyl)sulfonyl)benzenesulfonamide BAX, BCL2L1, BCL2A1 SMN1; SMN2 1943/4885DHFR 3072/4885TSHR 4576/4885
US-20080076779-A1 Reducing platelets in mammals blood and preventing/treating pro-thrombotic conditions and diseases via inhibitors of anti-apoptotic Bcl-2 family protein members BCL2, BAX, BCLAF1 SMN1; SMN2 1700/4885DHFR 2336/4885TSHR 3695/4885
US-20090176785-A1 METHOD OF TREATING ARTHRITIS MMP1, COL2A1, MMP13 SMN1; SMN2 2333/4885DHFR 129/4885TSHR 2198/4885
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 SMN1; SMN2 2635/4885DHFR 2722/4885TSHR 4739/4885
US-20160009687-A1 BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES BCL2, BCL3, BCL2L1 SMN1; SMN2 2213/4885DHFR 902/4885TSHR 4277/4885
US-20080182845-A1 METHOD OF PREVENTING OR TREATING ORGAN, HEMATOPOIETIC STEM CELL OR BONE MARROW TRANSPLANT REJECTION BST2, HLA-C, HLA-B SMN1; SMN2 3081/4885DHFR 859/4885TSHR 2151/4885
US-20160175316-A1 METHOD OF PREVENTING OR TREATING ORGAN, HEMATOPOIETIC STEM CELL OR BONE MARROW TRANSPLANT REJECTION BST2, HLA-C, HLA-B SMN1; SMN2 3081/4885DHFR 859/4885TSHR 2151/4885
US-20170096424-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 SMN1; SMN2 2848/4885DHFR 1855/4885TSHR 3724/4885

“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.