SCHEMBL426655

SCHEMBL426655

CN(C)c1ccnc2sc(C(N)=O)c(N)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 9/20 1.00
ALDH1A1 P00352 6/20 1.00
CDK19 Q9BWU1 6/20 1.00
HTT P42858 4/20 1.00
KDM4E B2RXH2 3/20 1.00
NPC1 O15118 2/20 0.70
RAB9A P51151 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
LMNA P02545 2/20 0.70
STAT1 P42224 1/20 0.70
LIMK1 P53667 2/20 0.68
MEN1 O00255 1/20 0.67
KMT2A Q03164 1/20 0.67
L3MBTL1 Q9Y468 1/20 0.67
HPGD P15428 2/20 0.63
ALOX15 P16050 2/20 0.63
TSHR P16473 2/20 0.63
NPSR1 Q6W5P4 1/20 0.63
IKBKB O14920 5/20 0.63
MAPK1 P28482 1/20 0.54

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
SCHEMBL12562445 0.89 ALDH1A1 (0.80) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL6100788 0.89 ALDH1A1 (0.80) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL4657890 0.87 CDK8 (0.76) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL8242540 0.85 ALDH1A1 (0.74) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL5229346 0.85 CDK8 (0.74) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL8242756 0.85 ALDH1A1 (0.74) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL4657854 0.84 CDK8 (0.73) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL17485804 0.83 ALDH1A1 (1.00) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL4659275 0.82 CDK8 (0.70) CDK8ALDH1A1CDK19HTTKDM4E
SCHEMBL4658096 0.81 CDK8 (0.68) CDK8ALDH1A1CDK19HTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10398749-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2019-09-03 US disclosed
US-10398680-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2019-09-03 US disclosed
US-20190240195-A1 METHODS OF TREATING MUSCULAR DYSTROPHY Board of Regents of the Nevada System of Higher Education, on behalf of the Univ of Nevada, Reno (US) 2019-08-08 US disclosed
US-10272069-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2019-04-30 US disclosed
US-20190111034-A1 COMPOUNDS FOR TREATMENT OF HYPOPROLIFERATIVE DISORDERS Apriligen, Inc. 2019-04-18 US disclosed
US-10206903-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2019-02-19 US disclosed
US-10154992-B2 Compounds and methods for treating HIV infection THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-12-18 US disclosed
US-10028992-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2018-07-24 US disclosed
US-10028992-B2 Methods of treating muscular dystrophy BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, RENO (US) 2018-07-24 US disclosed
EP-2892525-B1 METHODS OF TREATING MUSCULAR DYSTROPHY UNIV NEVADA RENO (US) 2018-06-13 EP disclosed
US-20130129677-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections SIGA TECHNOLOGIES, INC. (US) 2013-05-23 US disclosed
US-20130129677-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections SIGA TECHNOLOGIES, INC. (US) 2013-05-23 US disclosed
US-20130129677-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections SIGA TECHNOLOGIES, INC. (US) 2013-05-23 US disclosed
US-20120022046-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections SIGA TECHNOLOGIES, INC. 2012-01-26 US disclosed
US-20120022046-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections SIGA TECHNOLOGIES, INC. 2012-01-26 US disclosed
US-20120022046-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections SIGA TECHNOLOGIES, INC. 2012-01-26 US disclosed
WO-2010099166-A1 THIENOPYRIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DENGUE VIRUS INFECTIONS SIGA TECHNOLOGIES, INC. (US) 2010-09-02 WO disclosed
US-20070219234-A1 Thienopyridine Derivatives SANKYO COMPANY, LIMITED (JP) 2007-09-20 US disclosed
CN-1968954-A Thienopyridine Derivatives SANKYO CO (JP) 2007-05-23 CN disclosed
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 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 (11 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-20120022046-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections TTPA, TPMT, SLC19A2 CDK8 2499/4885ALDH1A1 1271/4885CDK19 4207/4885
US-10272069-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 CDK8 2528/4885ALDH1A1 342/4885CDK19 4195/4885
US-10028992-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 CDK8 2528/4885ALDH1A1 342/4885CDK19 4195/4885
US-10398680-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 CDK8 2528/4885ALDH1A1 342/4885CDK19 4195/4885
US-10154992-B2 Compounds and methods for treating HIV infection CD4, CCR5, MMP8 CDK8 1366/4885ALDH1A1 482/4885CDK19 3399/4885
US-10398749-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 CDK8 2528/4885ALDH1A1 342/4885CDK19 4195/4885
US-20130129677-A1 Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections TTPA, TPMT, SLC19A2 CDK8 2516/4885ALDH1A1 1400/4885CDK19 4179/4885
US-20190240195-A1 METHODS OF TREATING MUSCULAR DYSTROPHY ITGB7, ITGA2B, ITGB1 CDK8 2528/4885ALDH1A1 342/4885CDK19 4195/4885
US-20190111034-A1 COMPOUNDS FOR TREATMENT OF HYPOPROLIFERATIVE DISORDERS CDK9, CDK8, CDK18 CDK8 2/4885ALDH1A1 4061/4885CDK19 4/4885
US-10206903-B2 Methods of treating muscular dystrophy ITGB7, ITGA2B, ITGB1 CDK8 2528/4885ALDH1A1 342/4885CDK19 4195/4885
US-20070219234-A1 Thienopyridine Derivatives RASGRP1, NRAS, HRH3 CDK8 2017/4885ALDH1A1 1073/4885CDK19 1842/4885

“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.