SCHEMBL1768871

SCHEMBL1768871

C=CC[n+]1cc[nH]c1C

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
Water SCHEMBL7145853 0.98 KDM4E (0.38)
SCHEMBL16340985 0.75
SCHEMBL13861388 0.75 KDM4E (0.33)
SCHEMBL207289 0.73 KDM4E (0.31)
SCHEMBL627800 0.73
SCHEMBL17004512 0.72
Hydrochloric Acid SCHEMBL572631 0.72 KDM4E (0.33)
Iodide SCHEMBL4566524 0.72 KDM4E (0.30)
Bromide SCHEMBL2439098 0.72 KDM4E (0.30)
Hydrochloric Acid SCHEMBL796577 0.71

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
EP-2502295-A1 SILICON-AIR BATTERIES Technion Research & Development Foundation Ltd. (IL) 2012-09-26 EP claimed
WO-2011061728-A1 SILICON-AIR BATTERIES TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2011-05-26 WO claimed
EP-1268440-A1 IMIDAZOLE CARBENES The Queen's University of Belfast (GB) 2003-01-02 EP claimed
WO-2001077081-A1 IMIDAZOLE CARBENES THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2001-10-18 WO claimed
CN-119255857-A Low viscosity metal ion containing liquids 切弗朗菲利浦化学公司 2025-01-03 CN disclosed
EP-3302795-A1 METHOD FOR THE HOMOGENEOUS CATALYTIC REDUCTIVE AMINATION OF CARBONYL COMPOUNDS BASF SE (DE) 2018-04-11 EP disclosed
WO-2016189129-A1 METHOD FOR THE HOMOGENEOUS CATALYTIC REDUCTIVE AMINATION OF CARBONYL COMPOUNDS BASF SE (DE) 2016-12-01 WO disclosed
EP-2539083-A1 CLEANING APPARATUS Enviroways Technologies Limited (GB) 2013-01-02 EP disclosed
EP-2502295-A1 SILICON-AIR BATTERIES Technion Research & Development Foundation Ltd. (IL) 2012-09-26 EP disclosed
WO-2011104519-A1 CLEANING APPARATUS ENVIROWAYS TECHNOLOGIES LIMITED (GB) 2011-09-01 WO disclosed
WO-2011061728-A1 SILICON-AIR BATTERIES TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2011-05-26 WO disclosed