SCHEMBL1541346

SCHEMBL1541346

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
MTNR1A P48039 4/20 0.46
MTNR1B P49286 4/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
HPGD P15428 3/20 0.43
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 1/20 0.41
KDM1A O60341 1/20 0.40
NPC1 O15118 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 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
SCHEMBL4905285 0.84 MAOA (0.50) MAOAMAOBMTNR1AMTNR1BCYP1A2
SCHEMBL1540158 0.84 MAOA (0.50) MAOAMAOBMTNR1AMTNR1BCYP1A2
SCHEMBL1541345 0.83 MAPT (0.54) MAPTMAOAMAOBMTNR1AMTNR1B
SCHEMBL10175128 0.79 MAOA (0.55) MAOAMAOBMTNR1AMTNR1BCYP1A2
SCHEMBL25274884 0.78 MAOA (0.53) MAOAMAOBMTNR1AMTNR1BCYP1A2
SCHEMBL25236742 0.78 MAOA (0.53) MAOAMAOBMTNR1AMTNR1BCYP1A2
SCHEMBL554681 0.78 MAOA (0.50) MAPTMAOAMAOBMTNR1AMTNR1B
SCHEMBL554680 0.78 MAOA (0.50) MAPTMAOAMAOBMTNR1AMTNR1B
SCHEMBL10078854 0.77 MAOA (0.46) MAOAMAOBMTNR1AMTNR1BSMN1; SMN2
SCHEMBL10058379 0.77 MAOA (0.46) MAOAMAOBMTNR1AMTNR1BSMN1; SMN2

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
EP-2308812-A2 N-acylsulfonamide apoptosis promoters Abbott Laboratories (US) 2011-04-13 EP 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-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 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
US-20130190488-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
US-20070015787-A1 Apoptosis promoters BAX, BCL2, API5 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
US-20060258657-A1 Apoptosis promoters BAX, BCL2, API5 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
US-20100022773-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
US-20050159427-A1 N-acylsulfonamide apoptosis promoters BAX, API5, CCAR2 MAPT 4640/4885MAOA 3900/4885MAOB 3134/4885
US-20100240715-A1 Apoptosis promoters BAX, BCL2, API5 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
US-20140187531-A1 APOPTOSIS PROMOTERS BAX, BCL2, API5 MAPT 4100/4885MAOA 2958/4885MAOB 2943/4885
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 MAPT 4463/4885MAOA 4170/4885MAOB 3740/4885

“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.