SCHEMBL16756502

SCHEMBL16756502

COc1ccc([C@@H]2Sc3ccccc3N(CCN(C)C)C(=O)[C@@H]2CC(=O)O)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1S Q13698 12/20 0.72
CYP3A4 P08684 3/20 0.71
TSHR P16473 2/20 0.71
ABCB11 O95342 2/20 0.71
LMNA P02545 2/20 0.71
KCNH2 Q12809 2/20 0.71
SLC22A1 O15245 1/20 0.71
CACNA1F O60840 1/20 0.71
ABCB1 P08183 1/20 0.71
HRH2 P25021 1/20 0.71
ADRA1A P35348 1/20 0.71
SCN1A P35498 1/20 0.71
SCN4A P35499 1/20 0.71
HTT P42858 1/20 0.71
SCN7A Q01118 1/20 0.71
CACNA1D Q01668 1/20 0.71
PLAUR Q03405 1/20 0.71
CACNA1C Q13936 1/20 0.71
SCN5A Q14524 1/20 0.71
SCN9A Q15858 1/20 0.71

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
SCHEMBL16756504 1.00 CACNA1S (0.72) CACNA1SCYP3A4TSHRABCB11LMNA
SCHEMBL1638938 1.00 CACNA1S (0.72) CACNA1SCYP3A4TSHRABCB11LMNA
SCHEMBL25288373 1.00 CACNA1S (0.72) CACNA1SCYP3A4TSHRABCB11LMNA
Diltiazem SCHEMBL428935 0.93 CACNA1S (0.85) CACNA1SCYP3A4TSHRABCB11LMNA
SCHEMBL8973326 0.93 CACNA1S (0.72) CACNA1SCYP3A4TSHRABCB11LMNA
Acetic Acid SCHEMBL4447699 0.86 CACNA1S (0.75) CACNA1SCYP3A4TSHRABCB11LMNA
Acetic Acid SCHEMBL4447700 0.86 CACNA1S (0.75) CACNA1SCYP3A4TSHRABCB11LMNA
Acetic Acid SCHEMBL8822753 0.86 CACNA1S (0.75) CACNA1SCYP3A4TSHRABCB11LMNA
SCHEMBL7348976 0.85 CACNA1S (0.79) CACNA1SCYP3A4TSHRABCB11LMNA
SCHEMBL7273620 0.85 CACNA1S (0.79) CACNA1SCYP3A4TSHRABCB11LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9078873-B2 Compositions and methods for preventing cardiac arrhythmia CORMATRIX CARDIOVASCULAR, INC. (US) 2015-07-14 US claimed
US-20150150913-A1 Compositions and Methods for Preventing Cardiac Arrhythmia CORVIVO CARDIOVASCULAR, INC. 2015-06-04 US claimed
EP-4744654-A1 SIGMA-1 RECEPTOR AGONIST SYSTOLIC BLOOD PRESSURE THERAPY Anavex Life Sciences Corp. (US) 2026-05-20 EP disclosed
US-20250281447-A1 SIGMA-1 RECEPTOR AGONIST SYSTOLIC BLOOD PRESSURE THERAPY ANAVEX LIFE SCIENCES CORP. 2025-09-11 US disclosed
US-12280034-B2 Sigma-1 receptor agonist systolic blood pressure therapy ANAVEX LIFE SCIENCES CORP. (US) 2025-04-22 US disclosed
US-20250032443-A1 TREATMENT OF MYOTONIC DISORDERS UNIVERSITY OF ROCHESTER (US) 2025-01-30 US disclosed
WO-2023086854-A1 TREATMENT OF MYOTONIC DISORDERS UNIVERSITY OF ROCHESTER (US) 2023-05-19 WO disclosed
US-11622955-B2 Sigma-1 receptor agonist systolic blood pressure therapy ANAVEX LIFE SCIENCES CORP. (US) 2023-04-11 US disclosed
US-20230071766-A1 SIGMA-1 RECEPTOR AGONIST SYSTOLIC BLOOD PRESSURE THERAPY ANAVEX LIFE SCIENCES CORP. (US) 2023-03-09 US disclosed
US-20210186920-A1 SIGMA-1 RECEPTOR AGONIST SYSTOLIC BLOOD PRESSURE THERAPY ANAVEX LIFE SCIENCES CORP. (US) 2021-06-24 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 (1 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-20250032443-A1 TREATMENT OF MYOTONIC DISORDERS ATP2A3, ATP2A1, ATP2A2 CACNA1S 38/4885CYP3A4 4831/4885TSHR 2604/4885

“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.