SCHEMBL1243447

SCHEMBL1243447

CN(Cc1ccccc1)S(N)(=O)=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.64
AOC3 Q16853 1/20 0.54
ALDH1A1 P00352 6/20 0.52
TSHR P16473 2/20 0.52
LMNA P02545 2/20 0.51
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
CA9 Q16790 2/20 0.48
CA1 P00915 1/20 0.48
CA5A P35218 1/20 0.48
CARM1 Q86X55 1/20 0.47
PRMT6 Q96LA8 1/20 0.47
PRMT8 Q9NR22 1/20 0.47
HTT P42858 2/20 0.46
ADRB2 P07550 1/20 0.46
MAPT P10636 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CA12 O43570 1/20 0.46
HPGD P15428 2/20 0.45

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
SCHEMBL6629548 0.81 ALDH1A1 (0.54) CA2AOC3ALDH1A1TSHRLMNA
SCHEMBL2057187 0.81 ALDH1A1 (0.54) CA2AOC3ALDH1A1TSHRLMNA
SCHEMBL1646282 0.80 AOC3 (0.57) CA2AOC3CA9CA1CA5A
SCHEMBL1647203 0.80 ALDH1A1 (0.47) CA2AOC3ALDH1A1LMNAMEN1
SCHEMBL31176735 0.80 TSHR (0.49) CA2ALDH1A1TSHRCA9CA1
SCHEMBL15899841 0.80 TAAR1 (0.46) CA2LMNA
SCHEMBL8930273 0.79 ALDH1A1 (0.52) CA2AOC3ALDH1A1TSHRLMNA
SCHEMBL15672917 0.79 ALDH1A1 (0.52) CA2AOC3ALDH1A1TSHRLMNA
SCHEMBL12305028 0.79 ALDH1A1 (0.52) CA2AOC3ALDH1A1TSHRLMNA
SCHEMBL5655809 0.79 ALDH1A1 (0.52) CA2AOC3ALDH1A1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180346416-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-12-06 US disclosed
US-10071957-B2 N-substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2018-09-11 US disclosed
EP-2870138-B1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH INC (US) 2018-08-22 EP disclosed
US-20150322002-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-11-12 US disclosed
CN-104797555-A N-substituted benzamides and methods of use thereof GENENTECH INC 2015-07-22 CN disclosed
EP-2870138-A2 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2015-05-13 EP disclosed
EP-1910404-B9 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2014-05-21 EP disclosed
WO-2014008458-A2 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2014-01-09 WO disclosed
EP-1910404-B1 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2013-11-27 EP disclosed
EP-1913016-B1 MACROCYCLIC PEPTIDES AS HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2013-01-16 EP disclosed
EP-1896421-A2 BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET Merck & Co., Inc. (US) 2008-03-12 EP disclosed
US-7285549-B2 Sulfamides and their use as endothelin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2007-10-23 US disclosed
US-7285549-B2 Sulfamides and their use as endothelin receptor antagonists ACTELION PHARMACEUTICALS LTD. (CH) 2007-10-23 US disclosed
WO-2007015855-A1 HCV NS3 PROTEASE INHIBITORS MERCK & CO., INC. (US) 2007-02-08 WO disclosed
WO-2007016441-A1 MACROCYCLIC PEPTIDES AS HCV NS3 PROTEASE INHIBITORS MERCK & CO., INC. (US) 2007-02-08 WO disclosed
US-20070027071-A1 HCV NS3 protease inhibitors MERCK SHARP & DOHME LLC 2007-02-01 US disclosed
WO-2007002254-A2 BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET MERCK & CO., INC. (US) 2007-01-04 WO disclosed
WO-2007002254-A2 BENZOCYCLOHEPTAPYRIDINES AS INHIBITORS OF THE RECEPTOR TYROSINE KINASE MET MERCK & CO., INC. (US) 2007-01-04 WO disclosed
US-20060293358-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2006-12-28 US disclosed
EP-1736467-A1 NOVEL SULFONAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-27 EP 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 (5 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-20070027071-A1 HCV NS3 protease inhibitors HAVCR2, GTF3C3, CTSC CA2 4706/4885AOC3 2108/4885ALDH1A1 1199/4885
US-20150322002-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, SNRPD2, RDX CA2 2585/4885AOC3 2482/4885ALDH1A1 1364/4885
US-10071957-B2 N-substituted benzamides and methods of use thereof BRIX1, SNRPD2, RDX CA2 2585/4885AOC3 2482/4885ALDH1A1 1364/4885
US-20180346416-A1 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, P2RX3 CA2 1725/4885AOC3 3195/4885ALDH1A1 1215/4885
US-20060293358-A1 Tyrosine kinase inhibitors ABL1, ERBB2, RET CA2 3285/4885AOC3 3054/4885ALDH1A1 1039/4885

“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.