SCHEMBL7701174

SCHEMBL7701174

CNC(C)COc1c(C)cccc1C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 10/20 0.61
CYP2D6 P10635 3/20 0.61
LMNA P02545 2/20 0.61
SCN1A P35498 2/20 0.61
SCN5A Q14524 2/20 0.61
SCN9A Q15858 2/20 0.61
CYP1A2 P05177 2/20 0.61
CYP3A4 P08684 2/20 0.61
NFKB1 P19838 2/20 0.61
KCNH2 Q12809 2/20 0.61
TSHR P16473 2/20 0.61
CYP2C9 P11712 1/20 0.61
KCNK3 O14649 1/20 0.61
CACNA1F O60840 1/20 0.61
KCNK2 O95069 1/20 0.61
GBA1 P04062 1/20 0.61
MAOA P21397 1/20 0.61
HTR2A P28223 1/20 0.61
SLC6A4 P31645 1/20 0.61
HTR2B P41595 1/20 0.61

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
SCHEMBL7698342 1.00 SCN4A (0.61) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL7698441 1.00 SCN4A (0.61) SCN4ACYP2D6LMNASCN1ASCN5A
Hydrochloric Acid SCHEMBL11657872 0.98 LMNA (0.62) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL11661140 0.90 NR3C1 (0.57) SCN4ACYP2D6LMNASCN1ASCN5A
Maleic Acid SCHEMBL11662225 0.86 HTR1D (0.48) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL13884448 0.85 SCN4A (0.61) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL5684024 0.81 SCN4A (0.58) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL8816903 0.81 SCN4A (0.58) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL8815305 0.81 SCN4A (0.58) SCN4ACYP2D6LMNASCN1ASCN5A
Hydrochloric Acid SCHEMBL8816944 0.80 LMNA (0.59) SCN4ACYP2D6LMNASCN1ASCN5A

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4105796-A ANTICONVULSIVES, ANTIARRHYTHMICS BOEHRINGER INGELHEIM GMBH (DE) 1978-08-08 US claimed
US-11492325-B2 Compounds as inhibitors of sodium channels HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2022-11-08 US disclosed
US-20190270696-A1 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2019-09-05 US disclosed
US-20190270696-A1 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2019-09-05 US disclosed
EP-3494105-A2 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS Human Biomolecular Research Institute (US) 2019-06-12 EP disclosed
WO-2017210371-A2 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2017-12-07 WO disclosed
WO-2017210371-A2 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) 2017-12-07 WO disclosed
WO-2014080306-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF CARDIOVASCULAR DISEASES KANDULA MAHESH (IN) 2014-05-30 WO disclosed
EP-1037871-B1 NOVEL ANTIARRHYTHMIC COMPOUNDS GYOGYSZERKUTATO INTEZET (HU) 2002-07-03 EP disclosed
US-6265445-B1 CARDIOVASCULAR DISORDERS GYOGYSZERKUTATO INTEZET KFT (HU) 2001-07-24 US disclosed
US-5688830-A SODIUM CHANNEL BLOCKERS AS ANALGESICS SYNTEX (U.S.A.) INC. (US) 1997-11-18 US disclosed
WO-1997027169-A1 (2-DIMETHYLPHENOXY-1-METHYLETHYL) ETHYLAMINE F.HOFFMANN-LA ROCHE AG (CH) 1997-07-31 WO disclosed
US-4105796-A ANTICONVULSIVES, ANTIARRHYTHMICS BOEHRINGER INGELHEIM GMBH (DE) 1978-08-08 US disclosed
US-4105796-A ANTICONVULSIVES, ANTIARRHYTHMICS BOEHRINGER INGELHEIM GMBH (DE) 1978-08-08 US disclosed
US-4105796-A ANTICONVULSIVES, ANTIARRHYTHMICS BOEHRINGER INGELHEIM GMBH (DE) 1978-08-08 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 (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-20190270696-A1 COMPOUNDS AS INHIBITORS OF SODIUM CHANNELS SCN1B, CACNA1E, SCN2B SCN4A 48/4885CYP2D6 2298/4885LMNA 1789/4885
US-11492325-B2 Compounds as inhibitors of sodium channels SCN1B, CACNA1E, SCN2B SCN4A 48/4885CYP2D6 2298/4885LMNA 1789/4885

“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.