SCHEMBL350437

SCHEMBL350437

Brc1[c]c(Br)c(Br)s1

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
SCHEMBL1364994 0.46 GPR35 (0.50)
Perbromobenzene SCHEMBL27124 0.36 ALDH1A1 (0.50)
Calcium Bromide SCHEMBL30888723 0.36
Calcium Bromide SCHEMBL20474462 0.33
SCHEMBL1136166 0.31
Methane SCHEMBL23044967 0.27
SCHEMBL11131006 0.27
Hydrogen Sulfide SCHEMBL1489554 0.27
SCHEMBL25275597 0.27
SCHEMBL21829105 0.27

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009077497-A2 AZOLYL METHYL OXIRANES, THE USE THEREOF, AND AGENTS CONTAINING THEM BASF SE (DE) 2009-06-25 WO claimed
US-8236788-B2 Azolylmethyloxiranes, use thereof for controlling plant pathogenic fungi, and agents containing the same BASF SE (DE) 2012-08-07 US disclosed
US-20120015981-A1 Active compound combinations BAYER CORPSCIENCE AG (DE) 2012-01-19 US disclosed
EP-2391214-A1 ACTIVE COMPOUND COMBINATIONS Bayer CropScience AG (DE) 2011-12-07 EP disclosed
EP-2391213-A1 ACTIVE COMPOUND COMBINATIONS Bayer CropScience AG (DE) 2011-12-07 EP disclosed
US-20110294855-A1 Active Compound Combinations BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
EP-2046784-B1 AZOLYLMETHYLOXIRANES, USE THEREOF FOR CONTROLLING PLANT PATHOGENIC FUNGI, AND AGENTS CONTAINING THE SAME BASF SE (DE) 2011-09-14 EP disclosed
CN-102177142-A Triazole and imidazole compounds, use thereof and agents containing them BASF SE 2011-09-07 CN disclosed
CN-102149707-A Imidazole and triazole compounds, their use and agents containing said compounds BASF SE 2011-08-10 CN disclosed
US-20110190122-A1 Triazole and Imidazole Compounds, Use Thereof and Agents Containing Them BASF SE (DE) 2011-08-04 US disclosed
EP-2041125-B1 AZOLYLMETHYLOXIRANES, THEIR USE FOR CONTROLLING PHYTOPATHOGENIC FUNGI AND AGENTS CONTAINING SAID COMPOUNDS BASF SE (DE) 2011-01-26 EP disclosed
WO-2010086120-A1 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AG (DE) 2010-08-05 WO disclosed
WO-2010086109-A1 ACTIVE COMPOUND COMBINATIONS BAYER CROPSCIENCE AG (DE) 2010-08-05 WO disclosed
US-20090325801-A1 Azolylmethyloxiranes, Use Thereof for Controlling Plant Pathogenic Fungi, and Agents Containing the Same BASF SE (DE) 2009-12-31 US disclosed
US-20090270256-A1 Azolylmethyloxiranes, Use Thereof for Controlling Plant Pathogenic Fungi, and Agents Containing the Same BASF SE (DE) 2009-10-29 US disclosed
US-20090197929-A1 Azolylmethyloxiranes, Their Use for Controlling Phytopathogenic Fungi and Agents Containing Said Compounds BASF SE (DE) 2009-08-06 US disclosed
WO-2009077497-A2 AZOLYL METHYL OXIRANES, THE USE THEREOF, AND AGENTS CONTAINING THEM BASF SE (DE) 2009-06-25 WO disclosed
EP-2046784-A2 AZOLYLMETHYLOXIRANES, USE THEREOF FOR CONTROLLING PLANT PATHOGENIC FUNGI, AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-04-15 EP disclosed
WO-2008012234-A2 AZOLYLMETHYLOXIRANES, USE THEREOF FOR CONTROLLING PLANT PATHOGENIC FUNGI, AND AGENTS CONTAINING THE SAME BASF SE (DE) 2008-01-31 WO disclosed
EP-0399267-A2 8-Substituted-4-(heterocyclylmethylamino)-quinolines, their use and drugs prepared from them BASF Aktiengesellschaft (DE) 1990-11-28 EP disclosed