SCHEMBL2675632

SCHEMBL2675632

CC(C)(C)OC(=O)N[C@H](C=CC(=O)O)CSc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 6/20 0.46
PPARG P37231 5/20 0.46
PPARD Q03181 2/20 0.45
MTNR1A P48039 3/20 0.43
MTNR1B P49286 3/20 0.43
CTSK P43235 7/20 0.43
MMP13 P45452 1/20 0.42
CTSS P25774 3/20 0.41
ATM Q13315 1/20 0.41
ACE P12821 1/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40

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
SCHEMBL2947991 1.00 PPARA (0.46) PPARAPPARGPPARDMTNR1AMTNR1B
SCHEMBL2947993 1.00 PPARA (0.46) PPARAPPARGPPARDMTNR1AMTNR1B
SCHEMBL2675628 1.00 PPARA (0.46) PPARAPPARGPPARDMTNR1AMTNR1B
SCHEMBL1542228 0.92 PPARA (0.46) PPARAPPARGPPARDMTNR1AMTNR1B
SCHEMBL3593703 0.92 PPARA (0.46) PPARAPPARGPPARDMTNR1AMTNR1B
SCHEMBL22202893 0.86 CTSK (0.50) PPARAPPARGPPARDMTNR1AMTNR1B
SCHEMBL18549277 0.83 PPARA (0.45) PPARAPPARGPPARDCTSKCTSS
SCHEMBL18549299 0.83 PPARA (0.45) PPARAPPARGPPARDCTSKCTSS
SCHEMBL4275633 0.81 ATM (0.55) PPARAPPARGCTSKCTSSATM
SCHEMBL5821214 0.81 ATM (0.55) PPARAPPARGCTSKCTSSATM

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 25 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-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-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
EP-1318978-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2003-06-18 EP disclosed
US-20020086887-A1 N-Acylsulfonamide apoptosis promoters ABBVIE INC. 2002-07-04 US disclosed
WO-2002024636-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2002-03-28 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-20020086887-A1 N-Acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 PPARA 2308/4885PPARG 2763/4885PPARD 3293/4885
US-20060128706-A1 Apoptosis promoters BAX, BCL2, API5 PPARA 2112/4885PPARG 1697/4885PPARD 3254/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 PPARA 2308/4885PPARG 2763/4885PPARD 3293/4885
US-20130190488-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 PPARA 2112/4885PPARG 1697/4885PPARD 3254/4885
US-20070015787-A1 Apoptosis promoters BAX, BCL2, API5 PPARA 2112/4885PPARG 1697/4885PPARD 3254/4885
US-20140187531-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 PPARA 2112/4885PPARG 1697/4885PPARD 3254/4885
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 PPARA 631/4885PPARG 498/4885PPARD 862/4885

“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.