SCHEMBL8633666

SCHEMBL8633666

CC(C)Oc1ccc(Oc2cc(Cl)c(OCC=C(Br)Br)cc2Cl)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.36
TPO P07202 1/20 0.36
EPX P11678 1/20 0.36
LPO P22079 1/20 0.36
PTGDR Q13258 5/20 0.36
ACACB O00763 4/20 0.35
ACACA Q13085 1/20 0.35
FFAR1 O14842 1/20 0.35
CSNK2A1 P68400 2/20 0.34
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL8634719 0.93 PTGDR (0.34) PTGDRACACBACACAFFAR1CSNK2A1
SCHEMBL8634698 0.88 HTT (0.37) MPOTPOEPXLPOPTGDR
SCHEMBL8633759 0.85 PNLIP (0.38) MPOTPOEPXLPOFFAR1
SCHEMBL8633096 0.81 HTT (0.34) PTGDRACACBACACAFFAR1CSNK2A1
SCHEMBL8636445 0.80 ACACB (0.38) PTGDRACACBACACACYP1A2GAA
SCHEMBL8633770 0.80 PPARD (0.37) PTGDRACACBACACA
SCHEMBL8632604 0.79 ACACB (0.37) PTGDRACACBACACACYP1A2GAA
SCHEMBL8634953 0.78 PPARG (0.37) PTGDRACACBACACAGAAPOLB
SCHEMBL8634461 0.78 ACACB (0.36) PTGDRACACBACACATSHRCYP2D6
SCHEMBL8633857 0.78 ADRA2A (0.34) PTGDRACACBACACATSHRCYP1A2

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