SCHEMBL9751245

SCHEMBL9751245

CCCCCCCCCc1ccc(OCCOc2c(Br)c(Br)c(Br)c(Br)c2Br)c(Br)c1Br

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 1/20 0.38
CNR2 P34972 10/20 0.36
HTT P42858 4/20 0.36
MAPT P10636 3/20 0.36
MAPK1 P28482 2/20 0.36
THRB P10828 2/20 0.36
APAF1 O14727 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RAD52 P43351 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CNR1 P21554 7/20 0.36
TYR P14679 2/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX5 P09917 1/20 0.36

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
SCHEMBL9751133 0.92 TYR (0.38) TSHRMEN1KMT2AALDH1A1CNR2
SCHEMBL9751106 0.92 TYR (0.38) TSHRMEN1KMT2AALDH1A1CNR2
SCHEMBL9751184 0.87 MEN1 (0.39) TSHRMEN1KMT2AALDH1A1CNR2
SCHEMBL9751169 0.87 MEN1 (0.39) TSHRMEN1KMT2AALDH1A1CNR2
SCHEMBL9751191 0.87 MEN1 (0.39) TSHRMEN1KMT2AALDH1A1CNR2
SCHEMBL9751201 0.85 HTT (0.38) TSHRMEN1KMT2AALDH1A1CNR2
SCHEMBL8636845 0.76 MEN1 (0.44) MEN1KMT2AALDH1A1CNR2HTT
SCHEMBL27957034 0.76 MEN1 (0.44) MEN1KMT2AALDH1A1CNR2HTT
SCHEMBL27956894 0.76 MEN1 (0.44) MEN1KMT2AALDH1A1CNR2HTT
SCHEMBL9751330 0.75 HTR2A (0.39) TSHRMEN1KMT2AALDH1A1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0388445-A4 FLAME RETARDANT HIGHER ALKYL BISPHENOXY ALKANES AND THEIR APPLICATION TO ABS POLYMER SYSTEMS 1991-07-03 EP claimed
EP-0388445-A1 FLAME RETARDANT HIGHER ALKYL BISPHENOXY ALKANES AND THEIR APPLICATION TO ABS POLYMER SYSTEMS GREAT LAKES CHEMICAL CORPORATION (US) 1990-09-26 EP claimed
WO-1990000165-A1 FLAME RETARDANT HIGHER ALKYL BISPHENOXY ALKANES AND THEIR APPLICATION TO ABS POLYMER SYSTEMS GREAT LAKES CHEMICAL CORPORATION (US) 1990-01-11 WO claimed
US-4880862-A ACRYLONITRILE-BUTADIENE-STYRENE COPOLYMER, HALOGENATED UNSYMMETRICAL HIGHER ALKYL BISPHENOXY ALKANE GREAT LAKES CHEMICAL CORPORATION (US) 1989-11-14 US claimed
EP-0388445-A4 FLAME RETARDANT HIGHER ALKYL BISPHENOXY ALKANES AND THEIR APPLICATION TO ABS POLYMER SYSTEMS 1991-07-03 EP disclosed
EP-0388445-A1 FLAME RETARDANT HIGHER ALKYL BISPHENOXY ALKANES AND THEIR APPLICATION TO ABS POLYMER SYSTEMS GREAT LAKES CHEMICAL CORPORATION (US) 1990-09-26 EP disclosed
WO-1990000165-A1 FLAME RETARDANT HIGHER ALKYL BISPHENOXY ALKANES AND THEIR APPLICATION TO ABS POLYMER SYSTEMS GREAT LAKES CHEMICAL CORPORATION (US) 1990-01-11 WO disclosed
US-4880862-A ACRYLONITRILE-BUTADIENE-STYRENE COPOLYMER, HALOGENATED UNSYMMETRICAL HIGHER ALKYL BISPHENOXY ALKANE GREAT LAKES CHEMICAL CORPORATION (US) 1989-11-14 US disclosed