SCHEMBL4883436

SCHEMBL4883436

CC(C)C(=O)C1=[C]CCC1

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
SCHEMBL9433880 0.72
SCHEMBL5806873 0.70
SCHEMBL8465599 0.65
SCHEMBL11459831 0.61
SCHEMBL9256010 0.57
SCHEMBL15468834 0.56
SCHEMBL24376772 0.54 SMN1; SMN2 (0.42)
SCHEMBL1822544 0.54
SCHEMBL291795 0.54
SCHEMBL16522849 0.53 KDM4E (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9421175-B2 Prevention of retinopathy by inhibition of the visual cycle LARSEN LARS MICHAEL (DK) 2016-08-23 US disclosed
US-20080214668-A1 USE OF RETINOIDS TO TREAT HIGH BLOOD PRESSURE AND OTHER CARDIOVASCULAR DISEASE OREGON HEALTH AND SCIENCES UNIVERSITY (US) 2008-09-04 US disclosed
US-20070249713-A1 Prevention of Retinopathy by Inhibition of the Visual Cycle LARSEN LARS M 2007-10-25 US disclosed
US-20070154981-A1 Insulin-producing cells derived from stem cells THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2007-07-05 US disclosed
EP-1727529-A2 PREVENTION OF RETINOPATHY BY INHIBITION OF THE VISUAL CYCLE Larsen, Lars, Michael (DK) 2006-12-06 EP disclosed
WO-2005087210-A2 PREVENTION OF RETINOPATHY BY INHIBITION OF THE VISUAL CYCLE LARSEN LARS MICHAEL (DK) 2005-09-22 WO disclosed
WO-2005045001-A2 INSULIN-PRODUCING CELLS DERIVED FROM STEM CELLS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2005-05-19 WO disclosed
US-20030008919-A1 Use of retinoids to treat high blood pressure and other cardiovascular disease ROULLET JEAN-BAPTISTE (US) 2003-01-09 US disclosed
US-6437003-B1 STROKES ROULLET JEAN-BAPTISTE (US) 2002-08-20 US disclosed
US-5830760-A IMMORTALIZED STEM CELL LINE FRED HUTCHINSON CANCER RESEARCH CENTER (US) 1998-11-03 US disclosed
WO-1995004143-A1 CREATING NOVEL HEMATOPOIETIC CELL LINES BY EXPRESSING ALTERED RETINOIC ACID RECEPTORS FRED HUTCHINSON CANCER RESEARCH CENTER (US) 1995-02-09 WO disclosed