SCHEMBL6653643

SCHEMBL6653643

O=C1CCCCS(=O)(=O)C1

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.45
TRIM33 Q9UPN9 2/20 0.45
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL7272667 0.97 TRIM24 (0.48) TRIM24TRIM33ALDH1A1
SCHEMBL4838366 0.92
Cyclopentanone SCHEMBL28195072 0.83 TRIM24 (0.59) TRIM24TRIM33ALDH1A1
SCHEMBL7092089 0.80 TRIM24 (0.30) TRIM24TRIM33
SCHEMBL561522 0.80
SCHEMBL11532547 0.75 TRIM24 (0.53) TRIM24TRIM33ALDH1A1
SCHEMBL7093394 0.74
SCHEMBL6653639 0.72 TRIM24 (0.43) TRIM24TRIM33ALDH1A1
SCHEMBL27628200 0.69
SCHEMBL4730800 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1247593-C Thiepino [3, 2-b ] dihydropyridines and related compositions and methods ORTHO MCNEIL PHARM INC (US) 2006-03-29 CN disclosed
CN-1522257-A Thiepino[3,2-b]dihydropyridines and related compositions and methods ����-������ҩƷ��˾ 2004-08-18 CN disclosed
EP-1265903-B1 THIEPINO[3,2-B]DIHYDROPYRIDINES AND RELATED COMPOSITIONS AND METHODS ORTHO MCNEIL PHARM INC (US) 2004-05-12 EP disclosed
EP-1040097-B1 POTASSIUM CHANNEL OPENERS ABBOTT LAB (US) 2004-04-14 EP disclosed
US-6593335-B1 Disease than can be ameliorated with a potassium channel opener in a host mammal, comprising administering to the mammal in need thereof a therapeutically effective amount of the compound of claim 1; said disease is epilepsy, Raynaud's ABBOTT LABORATORIES 2003-07-15 US disclosed
US-6420383-B1 CALCIUM CHANNEL BLOCKERS, HYPERSENSITIVITY, ALLERGY, ASTHMA, BRONCHOSPASM, DYSMENORRHEA, ESOPHAGEAL SPASM, GLAUCOMA, PREMATURE LABOR, URINARY TRACT DISORDERS, GASTROINTESTINAL MOTILITY DISORDERS AND CARDIOVASCULAR DISORDERS. ORTHO-MCNEIL PHARMACEUTICAL, INC. 2002-07-16 US disclosed
EP-1194429-A1 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2002-04-10 EP disclosed
US-20010036950-A1 Potassium channel openers CARROLL WILLIAM A (US) 2001-11-01 US disclosed
US-6265417-B1 MUSCLE RELAXANTS ABBOTT LABORATORIES 2001-07-24 US disclosed
WO-2000078768-A1 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 2000-12-28 WO disclosed
EP-1040097-A1 POTASSIUM CHANNEL OPENERS Abbott Laboratories (US) 2000-10-04 EP disclosed
WO-1999031059-A1 POTASSIUM CHANNEL OPENERS ABBOTT LABORATORIES (US) 1999-06-24 WO disclosed
EP-0241281-B1 Substituted thiacycloalkeno [3,2-b] pyridines, methods of preparation, compositions and method of use ORTHO PHARMA CORP (US) 1994-07-27 EP disclosed
US-4879384-A CYCLIC THIAALKANONE DIOXIDE AND UNSATURATED AMINE ESTER ORTHO PHARMACEUTICAL CORPORATION (US) 1989-11-07 US disclosed
US-4845225-A CARDIOVASCULAR, ANTIASTHMATIC AND ANTIBRONCHOCONSTRICTOR AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1989-07-04 US disclosed
US-4777167-A CALCIUM CHANNEL ANTAGONIST, ANTICOAGULANTS, ANTIASTHMATIC, BRONCHODILATOR AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-10-11 US disclosed
US-4705785-A Substituted thiacycloalkeno (3,2-b) pyridines and pharmaceutical compositions and method of use ORTHO PHARMACEUTICAL CORPORATION (US) 1987-11-10 US disclosed
EP-0241281-A2 Substituted thiacycloalkeno [3,2-b] pyridines, methods of preparation, compositions and method of use ORTHO PHARMACEUTICAL CORPORATION (US) 1987-10-14 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 (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-20010036950-A1 Potassium channel openers KCNJ2, KCNJ11, KCNJ1 TRIM24 3359/4885TRIM33 4469/4885ALDH1A1 709/4885

“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.