Hexobendine

Hexobendine

SCHEMBL125629

COc1cc(C(=O)OCCCN(C)CCN(C)CCCOC(=O)c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 1.00
SCN2A Q99250 2/20 1.00
SCN3A Q9NY46 2/20 1.00
ABCB1 P08183 10/20 0.69
ABCG2 Q9UNQ0 10/20 0.69
ABCC1 P33527 9/20 0.69
CYP3A4 P08684 2/20 0.66
CYP2D6 P10635 2/20 0.66
THPO P40225 2/20 0.66
MTOR P42345 2/20 0.66
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
PMP22 Q01453 2/20 0.64
SLC29A1 Q99808 5/20 0.61
LMNA P02545 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
ABCC4 O15439 1/20 0.57
CYP2C9 P11712 1/20 0.57
TSHR P16473 1/20 0.57
CHRM3 P20309 1/20 0.57

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
Hexobendine SCHEMBL2459088 0.99 SCN1A (0.97) SCN1ASCN2ASCN3AABCB1ABCG2
Hexobendine SCHEMBL10402178 0.99 SCN1A (0.97) SCN1ASCN2ASCN3AABCB1ABCG2
Hexobendine SCHEMBL317378 0.99 SCN1A (0.97) SCN1ASCN2ASCN3AABCB1ABCG2
SCHEMBL2459622 0.90 SCN1A (0.82) SCN1ASCN2ASCN3AABCB1ABCG2
SCHEMBL2459994 0.87 ABCB1 (0.92) SCN1ASCN2ASCN3AABCB1ABCG2
SCHEMBL2459996 0.87 ABCB1 (0.92) SCN1ASCN2ASCN3AABCB1ABCG2
SCHEMBL25981898 0.86 SCN1A (0.74) SCN1ASCN2ASCN3AABCB1ABCG2
Hydrochloric Acid SCHEMBL7883012 0.83 MEN1 (0.77) SCN1ASCN2ASCN3AABCB1ABCG2
Dilazep SCHEMBL11130839 0.83 SLC29A1 (0.77) SCN1ASCN2ASCN3AABCB1ABCG2
SCHEMBL11219537 0.82 SCN1A (0.69) SCN1ASCN2ASCN3AABCB1ABCG2

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 1861 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11998001-B2 Perfusion device for normothermic, ex vivo preservation of a mammalian brain YALE UNIVERSITY (US) 2024-06-04 US claimed
WO-2023183932-A2 MONOBODIES BINDING TO INTERCELLULAR ADHESION MOLECULE 2 (ICAM-2) NEW YORK UNIVERSITY (US) 2023-09-28 WO claimed
US-20230093487-A1 VASODILATORS FOR TREATMENT OF HEART FAILURE NORTHEAST OHIO MEDICAL UNIV (US) 2023-03-23 US claimed
US-11534375-B2 Solvent-free method of encapsulating a hydrophobic active AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2022-12-27 US claimed
US-11324748-B2 Vasodilators for treatment of heart failure NORTHEAST OHIO MEDICAL UNIVERSITY (US) 2022-05-10 US claimed
US-20210360913-A1 METHODS, SYSTEMS AND COMPOSITIONS FOR NORMOTHERMIC EX VIVO PRESERVATION OF INTACT ORGANS UNIV YALE (US) 2021-11-25 US claimed
EP-3485908-B1 THERAPEUTIC COMBINATION AND USE OF DLL4 ANTAGONIST ANTIBODIES AND ANTI-HYPERTENSIVE AGENTS MEREO BIOPHARMA 5 INC (US) 2021-08-18 EP claimed
EP-3749091-A1 METHODS, SYSTEMS AND COMPOSITIONS FOR NORMOTHERMIC EX VIVO RESTORATION AND PRESERVATION OF INTACT ORGANS Yale University (US) 2020-12-16 EP claimed
US-20200179248-A1 SOLVENT-FREE METHOD OF ENCAPSULATING A HYDROPHOBIC ACTIVE AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-06-11 US claimed
US-20190282580-A1 PRO-INFLAMMATORY ROLE FOR ADENOSINE UPTAKE AND METABOLISM LA JOLLA INSTITUTE FOR ALLERGY AND IMMUNOLOGY 2019-09-19 US claimed
US-5567689-A CONCURRENT ADMINISTERING MIXTURE OF URIDINE PHOSPHORYLASE INHIBITOR, URIDINE SECRETION INHIBITOR AND(OR) COMPOUNDWHICH COMPETES WITH URIDINE IN RENAL TRANSPORTATION MECHANISM THE UAB RESEARCH FOUNDATION (US) 1996-10-22 US claimed
EP-0716603-A1 METHODS AND COMPOSITIONS FOR INHIBITING URIDINE SECRETION THE UAB RESEARCH FOUNDATION (US) 1996-06-19 EP claimed
EP-0687172-A1 SOLID LIPID PARTICLES, PARTICLES OF BIOACTIVE AGENTS AND METHODS FOR THE MANUFACTURE AND USE THEREOF Pharmacia & Upjohn Aktiebolag (SE) 1995-12-20 EP claimed
WO-1995005180-A1 METHODS AND COMPOSITIONS FOR INHIBITING URIDINE SECRETION THE UAB RESEARCH FOUNDATION (US) 1995-02-23 WO claimed
WO-1994020072-A1 SOLID LIPID PARTICLES, PARTICLES OF BIOACTIVE AGENTS AND METHODS FOR THE MANUFACTURE AND USE THEREOF PHARMACIA AB (SE) 1994-09-15 WO claimed
EP-0594223-A1 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1994-04-27 EP claimed
EP-0416011-A4 CHEMOTHERAPEUTIC COMPOSITION FOR AIDS US COMMERCE (US) 1991-05-22 EP claimed
EP-0416011-A1 CHEMOTHERAPEUTIC COMPOSITION FOR AIDS THE UNITED STATES OF AMERICA as represented by the Secretary United States Department of Commerce (US) 1991-03-13 EP claimed
WO-1989011274-A1 CHEMOTHERAPEUTIC COMPOSITION FOR AIDS THE UNITED STATES OF AMERICA, AS REPRESENTED BY TH (US) 1989-11-30 WO claimed
EP-0217580-A2 Therapeutic nucleosides THE WELLCOME FOUNDATION LIMITED (GB) 1987-04-08 EP claimed

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-20230093487-A1 VASODILATORS FOR TREATMENT OF HEART FAILURE VASP, TNNI3, EDNRB SCN1A 2054/4885SCN2A 1529/4885SCN3A 1087/4885
US-11324748-B2 Vasodilators for treatment of heart failure VASP, TNNI3, EDNRB SCN1A 2054/4885SCN2A 1529/4885SCN3A 1087/4885

“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.