SCHEMBL4619010

SCHEMBL4619010

NC=CCc1ccco1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL10352734 0.83 — —
SCHEMBL4657208 0.82 — —
SCHEMBL10439395 0.82 ALDH1A1 (0.41) —
SCHEMBL10946107 0.81 ALDH1A1 (0.38) —
Ethylene Glycol SCHEMBL6423323 0.80 ALDH1A1 (0.40) —
SCHEMBL14660110 0.78 — —
SCHEMBL5642292 0.78 — —
SCHEMBL11213295 0.78 — —
SCHEMBL28914169 0.78 — —
SCHEMBL28743579 0.78 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5273984-A Bismuth complex having a carboxylic acid to form a salt of the basic antagonist excluding ranitidine GLAXO GROUP LIMITED (GB) 1993-12-28 — — US claimed
US-20230349922-A1 H2 Blockers Targeting Liver Macrophages for the Prevention and Treatment of Liver Disease and Cancer UNIVERSITÉ DE STRASBOURG (FR) 2023-11-02 — — US disclosed
EP-4196793-A1 H2 BLOCKERS TARGETING LIVER MACROPHAGES FOR THE PREVENTION AND TREATMENT OF LIVER DISEASE AND CANCER Université de Strasbourg (FR) 2023-06-21 — — EP disclosed
WO-2022034121-A1 H2 BLOCKERS TARGETING LIVER MACROPHAGES FOR THE PREVENTION AND TREATMENT OF LIVER DISEASE AND CANCER UNIVERSITÉ DE STRASBOURG (FR) 2022-02-17 — — WO disclosed
CN-106795127-A Diamine compound, dinitro compound and other compounds and preparation method thereof and relative purposes 微麦德斯公司 2017-05-31 — — CN disclosed
CN-106795127-A Diamine compound, dinitro compound and other compounds and preparation method thereof and relative purposes 微麦德斯公司 2017-05-31 — — CN disclosed
US-20160354342-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ACID-RELATED GASTROINTESTINAL DISORDERS CONTAINING A DITHIOLANE COMPOUND AND A GASTRIC ACID SECRETION INHIBITOR. SHAHID MUSLIM D (US) 2016-12-08 — — US disclosed
US-9457011-B2 Compositions and methods for the treatment of acid-related gastrointestinal disorders containing a dithiolane compound and a gastric acid secretion inhibitor SHAHID MUSLIM D (US) 2016-10-04 — — US disclosed
US-20150238463-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF ACID-RELATED GASTROINTESTINAL DISORDERS CONTAINING A DITHIOLANE COMPOUND AND A GASTRIC ACID SECRETION INHIBITOR SHAHID MUSLIM D (US) 2015-08-27 — — US disclosed
US-8277782-B2 Antiinflammatory agent, metalloproteinase inhibitor, anti-oxidant and modifier of cell redox status, vitamins, inhibitor of activation of nuclear factor kappa beta THE PROCTER & GAMBLE COMPANY (US) 2012-10-02 — — US disclosed
EP-0001699-B1 DERIVATIVES OF FURYL COMPOUNDS, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLAXO GROUP LIMITED (GB) 1982-02-24 — — EP disclosed
US-4288443-A HISTAMINE ANTAGONISTS GLAXO GROUP LIMITED (GB) 1981-09-08 — — US disclosed
US-4279819-A GASTROINTESTINAL DISORDERS ALLEN & HANBURYS LTD. (GB) 1981-07-21 — — US disclosed
US-4279819-A GASTROINTESTINAL DISORDERS ALLEN & HANBURYS LTD. (GB) 1981-07-21 — — US disclosed
US-4255440-A ANTIALLERGENS, ANTIULCER AGENTS ALLEN & HANBURYS LIMITED (GB) 1981-03-10 — — US disclosed
US-4169855-A ANTIHISTAMINES, ANTISECRETORY AGENTS Allen & Hansbury, Limited (GB) 1979-10-02 — — US disclosed
US-4169855-A ANTIHISTAMINES, ANTISECRETORY AGENTS Allen & Hansbury, Limited (GB) 1979-10-02 — — US disclosed
EP-0001699-A2 Derivatives of furyl compounds, their preparation and pharmaceutical compositions containing them GLAXO GROUP LIMITED (GB) 1979-05-02 — — EP disclosed
US-4128658-A HISTAMINE ANTAGONISTS ALLEN & HANBURYS LIMITED (GB) 1978-12-05 — — US disclosed
US-4128658-A HISTAMINE ANTAGONISTS ALLEN & HANBURYS LIMITED (GB) 1978-12-05 — — US disclosed
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