SCHEMBL2631378

SCHEMBL2631378

CCN1C(=O)OC[C@@H]1C

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
SCHEMBL15013873 1.00
SCHEMBL15134202 1.00
SCHEMBL23736401 0.81
SCHEMBL13261436 0.79 GBA1 (0.41)
SCHEMBL13261425 0.79 GBA1 (0.41)
SCHEMBL4416368 0.79 GBA1 (0.41)
SCHEMBL14376300 0.78 PIK3CD (0.66)
SCHEMBL19681671 0.78 PIK3CD (0.40)
SCHEMBL26185018 0.77 PIK3CD (0.37)
SCHEMBL6613350 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946188-B2 Anti-microbial agents and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2015-02-03 US disclosed
US-20140024611-A1 ANTI-MICROBIAL AGENTS AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2014-01-23 US disclosed
US-8461128-B2 Anti-microbial agents and uses thereof SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2013-06-11 US disclosed
US-20120258142-A1 GLYCOLIPIDS AND ANALOGUES THEREOF AS ANTIGENS FOR NKT CELLS THE SCRIPPS RESEARCH INSTITUTE (US) 2012-10-11 US disclosed
US-8163290-B2 Glycolipids and analogues thereof as antigens for NKT cells THE ROCKEFELLER UNIVERSITY (US) 2012-04-24 US disclosed
US-20110086053-A1 Glycolipids And Analogues Thereof As Antigens For NKT Cells THE ROCKEFELLER UNIVERSITY (US) 2011-04-14 US disclosed
US-7923013-B2 Glycolipids and analogues thereof as antigens for NKT cells THE ROCKEFELLER UNIVERSITY (US) 2011-04-12 US disclosed
US-20100099716-A1 CETP INHIBITORS MERCK SHARP & DOHME LLC 2010-04-22 US disclosed
US-20080119476-A1 Cetp Inhibitors ALI AMJAD 2008-05-22 US disclosed
US-20070238871-A1 Glycolipids And Analogues Thereof As Antigens For NKT Cells THE ROCKEFELLER UNIVERSITY (US) 2007-10-11 US disclosed
US-7276520-B2 Bicyclic piperidine derivatives as melanocortin-4 receptor agonists MERCK & CO., INC. (US) 2007-10-02 US disclosed
EP-1080082-B1 INTERMEDIATES FOR THE SYNTHESIS OF EPOTHILONES AND METHODS FOR THEIR PREPARATION NOVARTIS AG (CH) 2004-10-06 EP disclosed
US-6350878-B1 BASIFICATION AND IODINATION OF ALDEHYDE NOVARTIS AG (CH) 2002-02-26 US disclosed
EP-1080082-A1 INTERMEDIATES FOR THE SYNTHESIS OF EPOTHILONES AND METHODS FOR THEIR PREPARATION Novartis AG (CH) 2001-03-07 EP disclosed
WO-1999059985-A1 INTERMEDIATES FOR THE SYNTHESIS OF EPOTHILONES AND METHODS FOR THEIR PREPARATION NOVARTIS AG (CH) 1999-11-25 WO disclosed