SCHEMBL8405656

SCHEMBL8405656

ClC(Cl)=CCOc1cc(Cl)c(OCCCCOc2ccc(Br)cc2)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
DRD4 P21917 2/20 0.40
PPARD Q03181 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
ATM Q13315 1/20 0.36
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
NOS1 P29475 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
RAB9A P51151 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
KDM4E B2RXH2 3/20 0.33
MAOB P27338 2/20 0.33
LSS P48449 1/20 0.33
RECQL P46063 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
SCHEMBL8405387 0.97 HTT (0.40) HTTDRD4PPARDL3MBTL1LMNA
SCHEMBL8409203 0.92 HTT (0.39) HTTDRD4PPARDDRD2DRD3
SCHEMBL8405697 0.89 HTT (0.42) HTTDRD4DRD2DRD3MEN1
SCHEMBL8659679 0.89 HTT (0.39) HTTDRD4PPARDL3MBTL1LMNA
SCHEMBL8408754 0.87 HTT (0.39) HTTL3MBTL1MEN1KMT2ACYP1A2
SCHEMBL8345716 0.87 DRD4 (0.38) DRD4PPARDL3MBTL1LMNAATM
SCHEMBL8345714 0.87 DRD4 (0.38) DRD4PPARDL3MBTL1LMNAATM
SCHEMBL8659951 0.87 PPARD (0.39) HTTPPARDL3MBTL1MEN1KMT2A
SCHEMBL8896223 0.87 HTT (0.40) HTTDRD3KMT2ARAB9ACYP2D6
SCHEMBL8408726 0.86 HTT (0.42) HTTDRD4DRD2DRD3MEN1

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
US-5872137-A AROMATIC OXY DIHALOPRENE COMPOUNDS INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-02-16 US claimed
EP-0722430-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 1998-10-21 EP claimed
EP-0722430-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-07-24 EP claimed
WO-1996004228-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDAL/ACARICIDAL AGENTS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-02-15 WO claimed