S-Tocainide

S-Tocainide

SCHEMBL308742

Cc1cccc(C)c1NC(=O)[C@H](C)N

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9A

The experimentally established mechanism targets of S-Tocainide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN3A known ✓ Q9NY46 2/20 0.45
SCN4A known ✓ P35499 1/20 0.45
SCN5A known ✓ Q14524 1/20 0.45
SCN9A known ✓ Q15858 1/20 0.45
SCN1A known ✓ P35498 1/20 0.45
SCN2A known ✓ Q99250 1/20 0.45
ATM Q13315 2/20 0.57
HSP90AA1 P07900 1/20 0.53
XIAP P98170 1/20 0.51
BIRC2 Q13490 1/20 0.51
TAAR1 Q96RJ0 1/20 0.50
ANPEP P15144 1/20 0.49
ALDH1A1 P00352 2/20 0.49
DRD2 P14416 1/20 0.49
HTR2A P28223 1/20 0.49
HTR2B P41595 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CXCL8 P10145 1/20 0.48
PKM P14618 1/20 0.47
MEN1 O00255 2/20 0.47

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
Tocainide SCHEMBL15761 1.00 ATM (0.57) ATMHSP90AA1XIAPBIRC2TAAR1
Tocainide SCHEMBL9614374 0.98 ATM (0.55) ATMHSP90AA1XIAPBIRC2TAAR1
Tocainide SCHEMBL122779 0.98 ATM (0.55) ATMHSP90AA1XIAPBIRC2TAAR1
Tocainide SCHEMBL4338155 0.96 ATM (0.54) ATMHSP90AA1XIAPBIRC2TAAR1
Tocainide SCHEMBL27874301 0.95 ATM (0.53) ATMHSP90AA1XIAPBIRC2TAAR1
SCHEMBL11423763 0.87 NLRP3 (0.52) ATMANPEPALDH1A1MEN1KMT2A
SCHEMBL11436632 0.85 ATM (0.54) ATMHSP90AA1ANPEPALDH1A1DRD2
SCHEMBL12832472 0.84 ATM (0.60) ATMHSP90AA1ANPEPALDH1A1DRD2
Tocainide SCHEMBL13724527 0.84 SCN4A (0.65) ATMHSP90AA1ANPEPHTR2AHTR2B
SCHEMBL6356591 0.82 ATM (0.58) ATMHSP90AA1ANPEPALDH1A1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2009519467-A 2009-05-14 JP claimed
EP-1990639-A1 System and method for real-time diagnosis, treatment, and therapeutic drug monitoring UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-11-12 EP claimed
EP-1960775-A2 SYSTEM AND METHOD FOR MONITORING HEALTH USING EXHALED BREATH UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-08-27 EP claimed
US-20070258894-A1 System and Method for Real-Time Diagnosis, Treatment, and Therapeutic Drug Monitoring UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2007-11-08 US claimed
JP-2007525670-A 2007-09-06 JP claimed
WO-2007089328-A2 SYSTEM AND METHOD FOR MONITORING HEALTH USING EXHALED BREATH UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2007-08-09 WO claimed
US-20070167853-A1 System and method for monitoring health using exhaled breath UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2007-07-19 US claimed
EP-1718971-A2 SYSTEM AND METHOD FOR REAL-TIME DIAGNOSIS, TREATMENT, AND THERAPEUTIC DRUG MONITORING UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2006-11-08 EP claimed
WO-2005098429-A2 SYSTEM AND METHOD FOR REAL-TIME DIAGNOSIS, TREATMENT, AND THERAPEUTIC DRUG MONITORING UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2005-10-20 WO claimed
US-20050233459-A1 Marker detection method and apparatus to monitor drug compliance UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2005-10-20 US claimed
WO-2005056113-A1 COMPOUNDS FOR THE TREATMENT OF OCULAR DRYNESS CAUSED BY PHOTOREFRACTIVE SURGERY UNIVERSIDAD MIGUEL HERNANDEZ (ES) 2005-06-23 WO claimed
US-20050054942-A1 System and method for therapeutic drug monitoring UNIVERSITY OF FLORIDA 2005-03-10 US claimed
EP-1183011-A4 METHOD OF TREATING ANGINA AND/OR ANGINAL EQUIVALENTS, AND PHARMACEUTICAL COMPOSITIONS AND KIT RELATED THERETO ESPERION LUV DEV INC (US) 2005-01-19 EP claimed
JP-2003508349-A 2003-03-04 JP claimed
US-20020049155-A1 Cobalamin compounds useful as cardiovascular agents and as imaging agents HOGENKAMP HENRICUS P C (US) 2002-04-25 US claimed
EP-1183011-A1 METHOD OF TREATING ANGINA AND/OR ANGINAL EQUIVALENTS, AND PHARMACEUTICAL COMPOSITIONS AND KIT RELATED THERETO Esperion Mergerco, Inc. (US) 2002-03-06 EP claimed
WO-2001092283-A2 COBALAMIN COMPOUNDS USEFUL AS CARDIOVASCULAR AGENTS AND AS IMAGING AGENTS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2001-12-06 WO claimed
WO-2000069412-A1 METHOD OF TREATING ANGINA AND/OR ANGINAL EQUIVALENTS, AND PHARMACEUTICAL COMPOSITIONS AND KIT RELATED THERETO ESPERION LUV DEVELOPMENT, INC. (US) 2000-11-23 WO claimed
US-12605384-B2 Uses INTRA-CELLULAR THERAPIES, INC. (US) 2026-04-21 US disclosed
WO-1996032100-A1 COMPOSITIONS AND METHODS FOR TREATING PAIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1996-10-17 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 (2 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-20020049155-A1 Cobalamin compounds useful as cardiovascular agents and as imaging agents APOB, MMAB, CBS SCN3A 3723/4885SCN4A 3757/4885SCN5A 3192/4885
US-12605384-B2 Uses PDE2A, NPR1, PDE7A SCN3A 474/4885SCN4A 1411/4885SCN5A 538/4885

“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.