SCHEMBL9858387

SCHEMBL9858387

CC(Oc1c(Br)cc(Br)cc1Br)OC(C)Oc1c(Br)cc(Br)cc1Br

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.37
ALOX12 P18054 3/20 0.36
ALOX15 P16050 3/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.33
USP2 O75604 1/20 0.33
KMT2A Q03164 1/20 0.33
GABRA1 P14867 2/20 0.32
GABRB1 P18505 2/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
GABRA2 P47869 1/20 0.30
GABRB2 P47870 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
SCHEMBL1537774 0.91 HSD17B10 (0.39) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL10781184 0.83 ALOX12 (0.39) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL765589 0.81 ALOX12 (0.47) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL11171954 0.80 HSD17B10 (0.36) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL6280186 0.79 ALOX12 (0.35) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL6285002 0.77 HSD17B10 (0.41) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL10607884 0.73 HSD17B10 (0.33) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL11691799 0.72 ALDH1A1 (0.41) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL3840761 0.72 HSD17B10 (0.34) HSD17B10ALOX12ALOX15LMNANPSR1
SCHEMBL3413335 0.72 HSD17B10 (0.38) HSD17B10ALOX12ALOX15LMNANPSR1

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
EP-0192885-B1 HALOGENATED BISPHENOL A ETHER FLAME RETARDANT FOR ABS POLYMERS GREAT LAKES CHEMICAL CORPORATION (US) 1991-03-13 EP disclosed
US-4567218-A ACRYLONITRILE-BUTADIENE-STRYENE TERPOLYMER GREAT LAKES CHEMICAL CORPORATION (US) 1986-01-28 US disclosed