SCHEMBL6997313

SCHEMBL6997313

N#CC(Br)c1cccs1

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
SCHEMBL6814438 0.78
SCHEMBL2171539 0.78
SCHEMBL7596019 0.77 ALOX5 (0.43)
SCHEMBL963358 0.77 ALOX5 (0.39)
SCHEMBL6495803 0.74
SCHEMBL9442383 0.74
SCHEMBL9274944 0.74 ALOX5 (0.37)
SCHEMBL5582105 0.74
SCHEMBL3362289 0.74
Hydrochloric Acid SCHEMBL7379082 0.72 ALOX5 (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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115641919-A Bright and blind comparison information storage medium and application 北京化工大学 2023-01-24 CN disclosed
EP-0948500-B1 CYCLIC ORGANOSELENIUM COMPOUNDS, THEIR PREPARATION AND THEIR USES OXIS ISLE OF MAN LTD (GB) 2003-07-09 EP disclosed
US-6525040-B1 4,4-dimethyl-thieno-(3,2-e)-isoselenazine; antioxidants and cytoprotecting OXIS ISLE OF MAN, LIMITED (GB) 2003-02-25 US disclosed
EP-0850924-B1 Aromatic diselenides and selenosulphides for use as antioxidant agents OXIS ISLE OF MAN LTD (GB) 2001-03-14 EP disclosed
US-6040328-A ANTIOXIDANT AGENTS HAVING CYTOPROTECTING ACTIVITY, AND WATER SOLUBLE OXIS INTERNATIONAL S.A. (US) 2000-03-21 US disclosed
US-5973009-A ANTIOXIDANT AND CYTOPROTECTING ACTIVITY OXIS INTERNATIONAL S.A. (US) 1999-10-26 US disclosed
EP-0948500-A1 CYCLIC ORGANOSELENIUM COMPOUNDS, THEIR PREPARATION AND THEIR USES OXIS Isle of Man, Limited (GB) 1999-10-13 EP disclosed
WO-1998029417-A1 CYCLIC ORGANOSELENIUM COMPOUNDS, THEIR PREPARATION AND THEIR USES OXIS ISLE OF MAN, LIMITED (GB) 1998-07-09 WO disclosed