SCHEMBL4599386

SCHEMBL4599386

Brc1cc(C(Br)OC(Br)c2cc(Br)c(Br)c(Br)c2Br)c(Br)c(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
AKR1B1 P15121 2/20 0.32
APEX1 P27695 1/20 0.32
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL5847630 0.80 TDP1 (0.37) TDP1AKR1B1
SCHEMBL328794 0.77 TDP1 (0.40) TDP1AKR1B1APEX1
SCHEMBL4455527 0.77 TDP1 (0.40) TDP1AKR1B1APEX1
SCHEMBL6686565 0.77 TDP1 (0.34) TDP1
SCHEMBL11663568 0.74 TDP1 (0.32) TDP1
SCHEMBL11358290 0.74 EIF2AK2 (0.33) TDP1
SCHEMBL5186322 0.73 TDP1 (0.37) TDP1APEX1
SCHEMBL4601560 0.73 TDP1 (0.37) TDP1AKR1B1APEX1
SCHEMBL2882117 0.73 TDP1 (0.37) TDP1APEX1MAPTNPSR1
SCHEMBL9373547 0.73 TDP1 (0.37) TDP1APEX1MAPTNPSR1

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
CN-103987811-B Fire retardant, its preparation method and its purposes in polyurethane and polyisocyanurate foam 溴化合物有限公司 2016-08-24 CN disclosed
CN-103987811-A Flame retardants, processes for their preparation and uses thereof in polyurethane and polyisocyanurate foams BROMINE COMPOUNDS LTD 2014-08-13 CN disclosed
EP-1470097-B1 PENTABROMOBENZYL ALKYL ETHERS AND THEIR USE AS FIRE RETARDANTS BROMINE COMPOUNDS LTD (IL) 2008-04-16 EP disclosed
CN-1319923-C Pentabromobenzyl alkyl ethers and their use as fire retardants BROMINE COMPOUNDS LTD (IL) 2007-06-06 CN disclosed
EP-1773934-A2 NOVEL FIRE RETARDANTS Bromine Compounds Ltd. (IL) 2007-04-18 EP disclosed
US-7091270-B2 Pentabromobenzyl alkyl ethers and their use as fire retardants BROMINE COMPOUNDS LTD. (IL) 2006-08-15 US disclosed
WO-2006006154-A2 NOVEL FIRE RETARDANTS BROMINE COMPOUNDS LTD. (IL) 2006-01-19 WO disclosed
US-20050124746-A1 Pentabromobenzyl alkyl ethers and their use as fire retardants BROMINE COMPOUNDS LTD. (IL) 2005-06-09 US disclosed
CN-1625540-A Pentabromobenzyl alkyl ethers and their use as fire retardants BROMINE COMPOUNDS LTD (IL) 2005-06-08 CN disclosed
EP-1470097-A1 PENTABROMOBENZYL ALKYL ETHERS AND THEIR USE AS FIRE RETARDANTS Bromine Compounds Ltd. (IL) 2004-10-27 EP disclosed
WO-2003064361-A1 PENTABROMOBENZYL ALKYL ETHERS AND THEIR USE AS FIRE RETARDANTS BROMINE COMPOUNDS LTD. (IL) 2003-08-07 WO disclosed