SCHEMBL8632980

SCHEMBL8632980

ClC(Cl)=CCOc1c(Cl)cc(Oc2cccc(Cl)c2)cc1Br

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.37
AOC3 Q16853 1/20 0.37
WDR5 P61964 1/20 0.35
LMNA P02545 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
HSP90AA1 P07900 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
XBP1 P17861 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
THRA P10827 2/20 0.34
THRB P10828 2/20 0.34
CYP2C9 P11712 1/20 0.33
MMP14 P50281 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SLC6A4 P31645 2/20 0.32
RXRA P19793 1/20 0.32

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
SCHEMBL8653358 0.91 MAOB (0.41) MAOBAOC3WDR5LMNACYP1A2
SCHEMBL8633651 0.86 HSP90AA1 (0.44) HSP90AA1THRATHRBSLC6A4HTR2A
SCHEMBL8633461 0.82 PPARG (0.39) MAOBAOC3WDR5LMNAKMT2A
SCHEMBL8634454 0.80 PPARD (0.40) MAOBAOC3WDR5LMNAKMT2A
SCHEMBL8638773 0.79 FFAR4 (0.43) MMP14SLC6A4SLC6A2SLC6A3KMO
SCHEMBL8637854 0.78 MAOB (0.37) MAOBAOC3WDR5LMNAKMT2A
SCHEMBL8634044 0.76 HSP90AA1 (0.50) LMNAKMT2AMEN1HSP90AA1SLC6A4
SCHEMBL8635753 0.76 HTT (0.38) MAOBLMNAHSP90AA1THRATHRB
SCHEMBL8637012 0.76 HSP90AA1 (0.44) HSP90AA1THRATHRBSLC6A4SLC6A2
SCHEMBL8405460 0.75 MRGPRX4 (0.43) MAOBLMNACYP1A2CYP2C19CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed