SCHEMBL29478355

SCHEMBL29478355

O=C(Br)c1cc(Br)c(Br)c(Br)c1Br

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EIF2AK2 P19525 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
CSNK2A1 P68400 1/20 0.41
TDP1 Q9NUW8 1/20 0.37
AKR1B1 P15121 3/20 0.33
APEX1 P27695 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33
PTPN1 P18031 2/20 0.32
AKR1C4 P17516 1/20 0.31
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 1/20 0.31
AKR1C1 Q04828 1/20 0.31
TTR P02766 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
SCHEMBL49516 0.80 EIF2AK2 (0.45) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL4656443 0.78 EIF2AK2 (0.39) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL11813056 0.78 EIF2AK2 (0.39) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL38662144 0.76 EIF2AK2 (0.38) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL28387358 0.76 TDP1 (0.39) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL1668264 0.73 EIF2AK2 (0.40) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL10434528 0.72 EIF2AK2 (0.43) EIF2AK2CSNK2A2CSNK2BCSNK2A1TDP1
SCHEMBL9196525 0.72 PTPN1 (0.32) EIF2AK2CSNK2A2CSNK2BCSNK2A1PTPN1
SCHEMBL8495472 0.70 MAPT (0.51) TDP1AKR1C3
SCHEMBL9629952 0.69 EIF2AK2 (0.41) EIF2AK2CSNK2A2CSNK2BCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11390711-B2 Preparations having improved efficacy as flame retardants LANXESS DEUTSCHLAND GMBH (DE) 2022-07-19 US disclosed
CN-111234509-B Formulations, polyurethanes comprising them, processes for their production and their use 朗盛德国有限责任公司 2022-03-01 CN disclosed