SCHEMBL679823

SCHEMBL679823

CCC(O)Oc1c(Br)cc(C(C)(C)c2cc(Br)c(O)c(Br)c2)cc1Br

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.58
TSHR P16473 4/20 0.58
ALOX12 P18054 3/20 0.58
HIF1A Q16665 3/20 0.58
HSD17B10 Q99714 3/20 0.58
ALDH1A1 P00352 2/20 0.58
CYP3A4 P08684 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
HPGD P15428 1/20 0.58
CASP1 P29466 1/20 0.58
RECQL P46063 1/20 0.58
CHEK1 O14757 1/20 0.46
DAPK3 O43293 1/20 0.46
RET P07949 1/20 0.46
PDGFRB P09619 1/20 0.46
PIM1 P11309 1/20 0.46
PDGFRA P16234 1/20 0.46
KDR P35968 1/20 0.46
MAPK8 P45983 1/20 0.46
RPS6KA3 P51812 1/20 0.46

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
SCHEMBL12758368 0.82 ALDH1A1 (0.51) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL23584387 0.81 ALOX12 (0.66) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL20091584 0.79 ALDH1A1 (0.55) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL8761463 0.78 TSHR (0.66) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL14252079 0.77 HIF1A (0.59) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL681064 0.77 HSD17B10 (0.38) ALOX15TSHRALOX12HSD17B10CYP3A4
SCHEMBL5173922 0.76 TSHR (1.00) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL18647 0.76 TSHR (1.00) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL679893 0.76 TSHR (0.58) ALOX15TSHRALOX12HIF1AHSD17B10
SCHEMBL25898 0.75 ALDH1A1 (0.50) ALOX15TSHRALOX12HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8067497-B2 Flame-retardant for engineering thermoplastic applications BROMINE COMPOUNDS LTD. (IL) 2011-11-29 US disclosed