SCHEMBL4165259

SCHEMBL4165259

NC1CCC(CCC=O)CC1

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
SCHEMBL98083 0.87
SCHEMBL3020365 0.77
SCHEMBL96803 0.77
SCHEMBL1897478 0.76 ALDH1A1 (0.32)
SCHEMBL1895073 0.76 ALDH1A1 (0.38)
SCHEMBL2913315 0.76 ALDH1A1 (0.43)
SCHEMBL1894593 0.76 ALDH1A1 (0.43)
SCHEMBL887220 0.76
SCHEMBL911290 0.76 EPHX2 (0.30)
SCHEMBL18454688 0.76 DRD2 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8912148-B2 Methods of treating a disease or condition associated with abnormal angiogenesis COVX TECHNOLOGY IRELAND, LTD. (IE) 2014-12-16 US disclosed
US-8288349-B2 Anti-angiogenic compounds COVX TECHNOLOGY IRELAND, LTD. (IE) 2012-10-16 US disclosed
US-20090035851-A1 Modulators Of NOD1 Signaling THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2009-02-05 US disclosed
EP-1948211-A2 MODULATORS OF NOD1 SIGNALING THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2008-07-30 EP disclosed
WO-2007044989-A2 MODULATORS OF NOD1 SIGNALING THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-04-19 WO disclosed
US-20060258580-A1 Such as N-acyl/myristoyl-gamma-glucose-diaminopimelic acid dipeptides; for activation of nuclear factor kappa beta; for treatment of inflammatory diseases such as Crohn's disease and asthma; drug screening REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2006-11-16 US disclosed